data_2kq9_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 2kq9 _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 ' 8' ' ' ASN . . . . . . . . . . . . . 41.8 t30 . . . . . 0 N--CA 1.479 1.017 0 CA-C-O 120.621 0.248 . . . . 0.0 110.837 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 59.8 t -59.25 -35.7 59.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 124.039 0.936 . . . . 0.0 112.113 -174.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -56.51 -43.31 79.64 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.361 0.664 . . . . 0.0 111.601 -174.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.8 m -58.17 -43.8 87.65 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 123.989 0.806 . . . . 0.0 110.798 178.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.477 ' HA ' HG22 ' A' ' 15' ' ' ILE . 36.6 m-85 -74.24 -37.22 63.86 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.989 -176.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -57.59 -51.31 70.0 Favored 'General case' 0 C--O 1.244 0.802 0 C-N-CA 124.823 1.249 . . . . 0.0 110.497 -177.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.414 ' NZ ' ' HB2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -71.49 -42.45 68.03 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.276 -0.875 . . . . 0.0 111.568 -177.661 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.477 HG22 ' HA ' ' A' ' 12' ' ' TYR . 9.2 tt -67.68 -28.52 42.02 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 CA-C-N 118.474 0.579 . . . . 0.0 110.723 -177.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 42.1 mt -63.12 -47.41 82.93 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.299 0.64 . . . . 0.0 110.27 172.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.516 ' O ' ' HG3' ' A' ' 21' ' ' ARG . 48.2 mtm105 -62.57 -42.56 99.62 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 123.953 0.783 . . . . 0.0 111.229 176.186 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -59.74 -45.4 92.31 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 122.889 0.476 . . . . 0.0 110.198 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? -67.28 -42.11 84.34 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.776 -177.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.61 ' HB3' HG23 ' A' ' 69' ' ' ILE . 3.2 pt20 -71.13 -36.0 71.93 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-O 118.82 -0.609 . . . . 0.0 110.531 -174.621 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.516 ' HG3' ' O ' ' A' ' 17' ' ' ARG . 53.7 mtp180 -75.67 -39.6 57.33 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 123.791 0.682 . . . . 0.0 111.934 -173.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -64.2 -40.02 95.2 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 123.459 0.475 . . . . 0.0 109.869 174.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.495 ' HB2' HD12 ' A' ' 66' ' ' LEU . 98.8 mt -72.78 -29.82 63.6 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.44 175.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.422 ' HB2' ' HA ' ' A' ' 21' ' ' ARG . 1.4 m-85 -65.5 -54.79 23.29 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.478 0.711 . . . . 0.0 109.498 178.64 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -66.35 -27.29 67.77 Favored 'General case' 0 N--CA 1.482 1.164 0 O-C-N 123.939 0.774 . . . . 0.0 110.758 -177.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -58.77 -52.76 64.35 Favored 'General case' 0 C--N 1.356 0.882 0 O-C-N 124.077 0.86 . . . . 0.0 110.695 173.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 3.2 pp -87.32 -11.79 48.43 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 31.0 m170 . . . . . 0 N--CA 1.491 1.606 0 C-N-CA 123.866 0.866 . . . . 0.0 110.835 175.704 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.497 ' HB2' ' NE2' ' A' ' 63' ' ' GLN . 18.1 mt . . . . . 0 C--O 1.241 0.628 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -59.4 124.98 38.15 Favored Glycine 0 C--N 1.353 1.492 0 CA-C-O 118.808 -0.995 . . . . 0.0 111.521 177.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -62.49 -32.71 73.66 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 123.552 0.741 . . . . 0.0 112.22 -174.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.419 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 8.7 p -62.84 -39.04 83.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 123.251 0.62 . . . . 0.0 110.156 174.318 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -73.23 -43.11 40.3 Favored Glycine 0 C--N 1.348 1.198 0 O-C-N 123.686 0.616 . . . . 0.0 111.969 179.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.497 ' NE2' ' HB2' ' A' ' 58' ' ' LEU . 99.4 mt-30 -59.89 -45.34 92.84 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.028 0.931 . . . . 0.0 110.725 177.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -67.7 -40.57 84.31 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.121 0.968 . . . . 0.0 110.474 -178.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.432 ' O ' HG13 ' A' ' 69' ' ' ILE . 3.1 tp10 -65.15 -42.1 94.1 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.624 178.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.495 HD12 ' HB2' ' A' ' 23' ' ' LEU . 0.8 OUTLIER -70.31 -29.97 66.84 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.693 1.197 . . . . 0.0 111.35 179.927 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 41.9 ttt180 -69.4 -38.69 78.07 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 123.856 0.722 . . . . 0.0 109.665 175.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.85 -37.55 76.17 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.675 0.79 . . . . 0.0 111.038 177.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.61 HG23 ' HB3' ' A' ' 20' ' ' GLN . 98.7 mt -68.95 -40.29 80.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 123.61 0.764 . . . . 0.0 110.016 175.303 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -66.74 -39.21 87.86 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.7 0.8 . . . . 0.0 110.17 -178.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.58 -41.85 92.42 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.632 0.773 . . . . 0.0 110.493 176.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.436 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -65.28 -45.82 82.9 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.874 0.869 . . . . 0.0 111.186 179.463 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.484 HD22 HD13 ' A' ' 76' ' ' ILE . 80.5 mt -65.53 -31.99 73.34 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.161 0.984 . . . . 0.0 111.222 177.278 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.6 -34.07 69.56 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.479 0.712 . . . . 0.0 110.951 177.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -65.38 -36.19 83.22 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.006 0.522 . . . . 0.0 110.213 172.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.484 HD13 HD22 ' A' ' 73' ' ' LEU . 55.8 mt -66.68 -43.7 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 177.424 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.83 -30.44 71.49 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.533 1.133 . . . . 0.0 111.539 175.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.9 t -85.07 -17.27 37.92 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.833 0.853 . . . . 0.0 111.115 177.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 82.15 13.29 79.37 Favored Glycine 0 C--N 1.347 1.188 0 C-N-CA 123.412 0.53 . . . . 0.0 113.549 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 12.4 t -125.14 33.39 5.18 Favored 'General case' 0 CA--C 1.556 1.18 0 C-N-CA 124.176 0.99 . . . . 0.0 110.718 -177.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -62.84 144.32 56.72 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 121.91 -0.494 . . . . 0.0 110.087 165.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.21 31.06 32.34 Favored Glycine 0 C--N 1.341 0.848 0 O-C-N 123.965 0.791 . . . . 0.0 111.359 -171.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.7 m -130.46 114.55 15.67 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.717 0.807 . . . . 0.0 110.203 175.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 44.1 t -61.13 106.16 0.57 Allowed 'General case' 0 C--N 1.351 0.667 0 C-N-CA 124.101 0.96 . . . . 0.0 109.131 170.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 26.8 m -59.09 -31.01 44.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 O-C-N 124.236 0.96 . . . . 0.0 110.995 177.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 36.0 tttm -80.22 -7.56 59.04 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.084 0.953 . . . . 0.0 111.624 -176.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 62.8 m -119.83 -24.25 6.2 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 124.023 0.929 . . . . 0.0 111.91 174.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 65.04 27.8 72.74 Favored Glycine 0 CA--C 1.537 1.461 0 O-C-N 123.423 0.452 . . . . 0.0 112.103 -165.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -134.42 172.94 12.2 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.747 0.819 . . . . 0.0 110.133 -171.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.54 151.71 44.77 Favored 'General case' 0 CA--C 1.573 1.838 0 C-N-CA 124.377 1.071 . . . . 0.0 111.468 -172.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 8.7 mm -99.21 152.09 4.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 C-N-CA 125.237 1.415 . . . . 0.0 109.807 174.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.1 m -72.33 142.76 48.82 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 122.985 0.514 . . . . 0.0 109.737 173.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 46.2 tt0 -66.47 -32.14 73.32 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.866 0.466 . . . . 0.0 110.211 175.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.436 ' HA ' ' HE3' ' A' ' 97' ' ' LYS . 35.7 m-20 -66.83 -34.95 78.94 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.737 0.815 . . . . 0.0 111.393 175.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -60.77 -45.15 95.46 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 123.948 0.78 . . . . 0.0 110.297 173.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 98.3 mt -81.64 -27.25 34.21 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 -173.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.436 ' HE3' ' HA ' ' A' ' 94' ' ' ASP . 16.9 ptpt -73.69 -31.39 63.41 Favored 'General case' 0 N--CA 1.483 1.207 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 177.384 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.44 -43.36 19.01 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.769 0.828 . . . . 0.0 110.838 176.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.2 p -150.18 94.88 3.67 Favored Pre-proline 0 CA--C 1.556 1.179 0 C-N-CA 124.477 1.111 . . . . 0.0 109.325 -178.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -76.05 -10.14 19.47 Favored 'Trans proline' 0 C--N 1.379 2.173 0 C-N-CA 122.574 2.183 . . . . 0.0 112.967 177.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 15.3 p90 -101.8 48.91 0.87 Allowed 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.835 0.854 . . . . 0.0 110.545 -176.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 10.1 t -129.77 116.22 18.13 Favored Pre-proline 0 CA--C 1.55 0.968 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.383 171.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -76.16 -0.06 9.91 Favored 'Trans proline' 0 C--N 1.372 1.792 0 C-N-CA 122.348 2.032 . . . . 0.0 111.933 170.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.403 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 9.6 m-85 -115.56 146.36 41.81 Favored 'General case' 0 C--N 1.351 0.668 0 C-N-CA 123.974 0.909 . . . . 0.0 109.39 -176.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.421 ' SG ' ' HB2' ' A' ' 107' ' ' GLU . 23.4 p -77.11 162.87 27.12 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 172.56 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -59.87 -29.95 68.66 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 118.21 0.459 . . . . 0.0 111.881 -174.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.421 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 33.7 mt-10 -55.55 -52.3 64.18 Favored 'General case' 0 N--CA 1.481 1.101 0 O-C-N 123.986 0.804 . . . . 0.0 110.586 171.437 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.403 ' HB2' ' HB3' ' A' ' 104' ' ' PHE . 93.2 m -68.53 -39.59 81.1 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.278 178.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -63.43 -36.63 84.36 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.774 0.83 . . . . 0.0 111.115 -177.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -81.24 -22.36 38.79 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.71 0.804 . . . . 0.0 110.865 177.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.948 0 C-N-CA 123.838 0.855 . . . . 0.0 112.367 178.414 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 . . . . . 0 N--CA 1.477 0.88 0 CA-C-O 121.754 0.788 . . . . 0.0 110.329 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 49.2 t -77.58 -26.49 15.17 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-N 114.878 -1.056 . . . . 0.0 110.605 -177.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -67.06 -33.4 75.44 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.31 0.644 . . . . 0.0 110.759 178.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.8 m -61.94 -43.37 98.98 Favored 'General case' 0 C--O 1.243 0.732 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.378 172.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.41 ' HA ' HG21 ' A' ' 15' ' ' ILE . 22.6 m-85 -68.61 -37.97 80.19 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 114.941 -1.027 . . . . 0.0 110.585 177.414 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.464 ' HG2' HG21 ' A' ' 76' ' ' ILE . 2.5 tm-20 -56.47 -55.39 34.27 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 125.218 1.407 . . . . 0.0 110.302 -175.21 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.1 -45.03 78.46 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.79 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.45 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 12.5 tt -65.22 -31.63 54.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 CA-C-N 118.099 0.409 . . . . 0.0 110.847 -174.242 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.526 ' HB3' HG21 ' A' ' 69' ' ' ILE . 60.1 mt -64.57 -44.38 90.89 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.516 0.726 . . . . 0.0 110.449 174.577 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 53.1 mtt180 -63.44 -39.77 95.37 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 123.864 0.728 . . . . 0.0 111.357 177.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -65.93 -44.21 85.78 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.899 0.479 . . . . 0.0 110.473 -177.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.45 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -66.38 -43.58 85.5 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.893 178.276 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.611 ' HB3' HG23 ' A' ' 69' ' ' ILE . 2.0 pt20 -70.14 -29.41 66.32 Favored 'General case' 0 C--O 1.207 -1.171 0 CA-C-O 118.608 -0.711 . . . . 0.0 110.707 -177.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 87.5 mtt180 -74.93 -44.58 47.8 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.704 0.802 . . . . 0.0 112.114 -177.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -62.62 -43.37 98.99 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-O 121.371 0.605 . . . . 0.0 109.703 177.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.584 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 86.6 mt -70.59 -33.84 71.52 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 114.918 -1.037 . . . . 0.0 110.417 176.469 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.479 ' O ' ' HB2' ' A' ' 28' ' ' HIS . 0.2 OUTLIER -59.93 -56.62 19.42 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.285 0.634 . . . . 0.0 109.586 -177.917 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 20.4 ptt180 -64.62 -30.36 71.38 Favored 'General case' 0 N--CA 1.48 1.067 0 O-C-N 124.044 0.84 . . . . 0.0 110.895 -177.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -58.86 -57.75 11.68 Favored 'General case' 0 C--N 1.36 1.035 0 O-C-N 123.614 0.571 . . . . 0.0 111.359 175.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.601 ' HB2' ' HA ' ' A' ' 58' ' ' LEU . 2.2 pp -84.04 -25.32 29.96 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -174.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.479 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 3.5 m-70 . . . . . 0 N--CA 1.493 1.715 0 C-N-CA 123.845 0.858 . . . . 0.0 109.571 177.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.601 ' HA ' ' HB2' ' A' ' 27' ' ' LEU . 9.2 mt . . . . . 0 CA--C 1.539 0.54 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -81.08 142.76 23.5 Favored Glycine 0 C--N 1.349 1.273 0 CA-C-O 119.292 -0.727 . . . . 0.0 112.039 177.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -55.41 -54.74 39.94 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 124.365 1.066 . . . . 0.0 112.014 -174.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.4 p -53.29 -41.24 42.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 123.701 0.8 . . . . 0.0 111.492 178.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.405 ' HA3' HD21 ' A' ' 27' ' ' LEU . . . -67.89 -41.64 87.68 Favored Glycine 0 C--O 1.215 -1.053 0 O-C-N 123.767 0.667 . . . . 0.0 113.049 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -66.75 -46.34 75.7 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.205 0.602 . . . . 0.0 111.01 -178.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -63.27 -37.3 86.69 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.837 0.855 . . . . 0.0 110.884 178.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -71.27 -45.03 64.1 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.141 -179.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.7 mp -62.27 -33.23 74.22 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.562 1.145 . . . . 0.0 110.932 176.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 73.3 ttt180 -67.95 -43.35 79.28 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.672 0.789 . . . . 0.0 110.339 176.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -67.62 -38.36 83.8 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.755 0.822 . . . . 0.0 111.273 179.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.611 HG23 ' HB3' ' A' ' 20' ' ' GLN . 96.6 mt -69.61 -41.67 80.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.858 0.863 . . . . 0.0 110.075 177.011 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -63.73 -38.56 91.55 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.673 0.789 . . . . 0.0 110.76 178.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.495 ' HB2' HH12 ' A' ' 75' ' ' ARG . . . -63.95 -42.91 97.17 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.867 0.867 . . . . 0.0 110.687 177.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.438 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -66.0 -51.32 59.41 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 114.913 -1.039 . . . . 0.0 111.102 179.1 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.508 HD22 HD13 ' A' ' 76' ' ' ILE . 82.1 mt -62.59 -36.72 83.61 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.427 1.091 . . . . 0.0 111.886 -179.214 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.81 -43.9 97.59 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.469 0.708 . . . . 0.0 110.244 175.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.495 HH12 ' HB2' ' A' ' 71' ' ' ALA . 80.7 mtt85 -73.51 -26.3 60.82 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 115.244 -0.889 . . . . 0.0 112.267 179.43 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.508 HD13 HD22 ' A' ' 73' ' ' LEU . 80.6 mt -69.76 -46.59 74.05 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 CA-C-N 118.473 0.579 . . . . 0.0 109.536 174.615 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.74 -36.59 83.52 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.867 178.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 30.2 t -81.09 -17.77 48.86 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 123.729 0.812 . . . . 0.0 111.433 177.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 81.6 10.3 84.55 Favored Glycine 0 C--N 1.35 1.35 0 C-N-CA 123.198 0.428 . . . . 0.0 113.893 178.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.8 t -106.89 21.33 17.7 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 124.415 1.086 . . . . 0.0 110.261 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -61.46 142.79 56.76 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 122.578 0.351 . . . . 0.0 110.335 173.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.512 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 82.5 20.72 61.49 Favored Glycine 0 C--O 1.218 -0.864 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.521 -175.234 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 26.4 m -113.11 110.43 20.43 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 117.524 0.662 . . . . 0.0 109.825 174.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 49.2 t -73.45 93.91 2.03 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 124.459 1.104 . . . . 0.0 109.857 172.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 34.1 m -63.85 -22.25 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.298 1.039 . . . . 0.0 112.751 -176.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.524 ' HD3' ' HB3' ' A' ' 108' ' ' CYS . 56.4 tttm -69.83 -24.44 63.46 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 122.675 0.39 . . . . 0.0 111.585 -178.288 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 29.0 p -127.59 11.16 6.74 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 122.626 0.37 . . . . 0.0 110.879 173.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 56.63 27.11 54.38 Favored Glycine 0 C--N 1.36 1.9 0 C-N-CA 123.869 0.747 . . . . 0.0 114.932 176.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -135.96 -176.7 4.39 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.983 0.913 . . . . 0.0 110.228 -174.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.512 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 12.8 tpp180 -68.77 152.29 45.52 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 124.585 1.154 . . . . 0.0 112.664 -172.041 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 3.1 mm -92.16 145.36 7.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 165.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 61.8 m -66.99 145.25 55.6 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 122.252 0.221 . . . . 0.0 110.561 176.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -61.47 -39.94 92.72 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.254 0.622 . . . . 0.0 110.42 177.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.425 ' HA ' ' HG2' ' A' ' 97' ' ' LYS . 16.1 m-20 -65.2 -35.69 81.84 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.863 0.865 . . . . 0.0 111.303 178.266 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -63.87 -44.12 94.03 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.07 176.133 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 96.3 mt -75.45 -36.49 60.7 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.364 0.666 . . . . 0.0 112.502 -176.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.425 ' HG2' ' HA ' ' A' ' 94' ' ' ASP . 16.6 ptpt -73.25 -28.81 62.35 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 120.528 0.204 . . . . 0.0 110.713 -176.403 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -80.48 -48.66 12.49 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 123.923 0.765 . . . . 0.0 110.299 174.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.1 p -144.72 99.96 4.72 Favored Pre-proline 0 CA--C 1.555 1.161 0 C-N-CA 124.231 1.012 . . . . 0.0 109.299 -178.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -78.47 -5.57 14.97 Favored 'Trans proline' 0 C--N 1.373 1.836 0 C-N-CA 122.531 2.154 . . . . 0.0 113.021 178.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 18.9 p90 -105.34 54.37 0.7 Allowed 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.718 0.807 . . . . 0.0 110.032 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.8 t -135.14 101.57 11.24 Favored Pre-proline 0 CA--C 1.554 1.099 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.639 172.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -59.8 -18.79 50.91 Favored 'Trans proline' 0 C--N 1.382 2.295 0 C-N-CA 123.245 2.63 . . . . 0.0 113.096 172.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -104.48 126.09 51.25 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.841 0.857 . . . . 0.0 109.859 -177.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 16.5 p -69.39 158.88 34.25 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 171.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 62.9 tp60 -48.13 -39.84 21.78 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 114.09 1.144 . . . . 0.0 114.09 -169.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -69.37 -34.0 73.92 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-N 117.943 0.338 . . . . 0.0 111.849 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.524 ' HB3' ' HD3' ' A' ' 86' ' ' LYS . 99.5 m -72.33 -38.85 68.55 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.331 0.652 . . . . 0.0 111.396 174.19 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.58 -33.25 75.47 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.826 0.85 . . . . 0.0 111.017 176.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.99 -31.38 58.95 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.016 0.926 . . . . 0.0 111.047 176.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.848 0 C-N-CA 123.726 0.81 . . . . 0.0 112.276 -178.335 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.0 m120 . . . . . 0 N--CA 1.487 1.41 0 N-CA-C 111.817 0.303 . . . . 0.0 111.817 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 86.2 t -50.98 -41.21 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.607 1.163 . . . . 0.0 112.106 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -64.21 -37.4 87.35 Favored 'General case' 0 N--CA 1.484 1.27 0 O-C-N 123.722 0.639 . . . . 0.0 111.499 -176.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 17.4 m -63.0 -42.5 99.86 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.556 0.742 . . . . 0.0 110.042 176.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.48 ' HA ' HG22 ' A' ' 15' ' ' ILE . 28.3 m-85 -72.25 -33.79 67.77 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-N 114.611 -1.177 . . . . 0.0 110.735 179.131 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -59.73 -52.53 65.11 Favored 'General case' 0 C--O 1.246 0.875 0 C-N-CA 125.082 1.353 . . . . 0.0 110.268 -175.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.508 ' HZ1' ' HB2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -67.05 -48.49 68.14 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.995 179.518 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.48 HG22 ' HA ' ' A' ' 12' ' ' TYR . 13.3 tt -64.66 -29.65 48.0 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.35 0 CA-C-N 118.197 0.453 . . . . 0.0 110.688 -173.031 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.52 ' HB3' HG21 ' A' ' 69' ' ' ILE . 45.5 mt -62.34 -50.53 71.23 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.205 0.602 . . . . 0.0 110.248 172.27 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 52.3 mtm180 -64.23 -28.52 69.79 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.488 -0.778 . . . . 0.0 112.441 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -80.98 -33.34 33.85 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.302 0.641 . . . . 0.0 110.351 -177.302 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.447 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -69.46 -42.6 74.67 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.021 172.698 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.613 ' HB3' HG23 ' A' ' 69' ' ' ILE . 1.4 pt20 -71.37 -22.59 61.87 Favored 'General case' 0 C--O 1.208 -1.083 0 CA-C-O 119.349 -0.358 . . . . 0.0 110.324 179.554 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 32.6 mtt180 -62.84 -60.01 4.07 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.188 0.595 . . . . 0.0 110.52 173.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -60.98 -34.22 74.44 Favored 'General case' 0 N--CA 1.48 1.051 0 O-C-N 123.933 0.771 . . . . 0.0 110.833 -178.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 86.5 mt -69.08 -51.87 34.22 Favored 'General case' 0 C--N 1.352 0.707 0 C-N-CA 122.984 0.514 . . . . 0.0 111.336 176.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -56.19 -39.6 72.66 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 123.552 0.741 . . . . 0.0 111.416 -173.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 18.1 ptt180 -78.02 -33.36 51.16 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 122.428 0.291 . . . . 0.0 111.2 178.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 25.2 ttm180 -65.1 -41.42 94.95 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.517 0.727 . . . . 0.0 111.361 177.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.3 pp -94.02 -28.58 15.68 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.799 0.44 . . . . 0.0 111.193 -172.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 167.591 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.8 mt . . . . . 0 CA--C 1.547 0.847 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -64.65 145.01 49.11 Favored Glycine 0 N--CA 1.477 1.387 0 CA-C-O 119.592 -0.56 . . . . 0.0 113.27 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -64.07 -60.35 3.34 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.699 0.8 . . . . 0.0 111.719 -174.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.2 t -58.89 -32.34 47.03 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 123.881 0.872 . . . . 0.0 110.2 177.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.509 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -59.66 -51.77 57.02 Favored Glycine 0 C--N 1.353 1.511 0 O-C-N 124.051 0.844 . . . . 0.0 112.624 174.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -72.27 -36.66 69.07 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 124.098 0.959 . . . . 0.0 112.339 -175.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -73.28 -38.77 65.79 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.413 0.685 . . . . 0.0 110.369 -176.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -71.22 -37.05 72.05 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.627 174.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.509 ' HB2' ' O ' ' A' ' 62' ' ' GLY . 6.2 tp -58.62 -45.95 88.13 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 124.606 1.162 . . . . 0.0 109.568 177.209 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 47.4 ttt180 -64.84 -38.84 92.31 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.481 1.112 . . . . 0.0 110.5 -178.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.52 -36.64 83.2 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.914 177.015 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.613 HG23 ' HB3' ' A' ' 20' ' ' GLN . 95.0 mt -69.86 -49.79 54.24 Favored 'Isoleucine or valine' 0 C--N 1.356 0.86 0 C-N-CA 123.594 0.758 . . . . 0.0 110.83 178.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 52.6 m-20 -65.18 -35.64 81.71 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.753 0.821 . . . . 0.0 111.151 -177.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.426 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -64.88 -45.5 85.73 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.312 0.645 . . . . 0.0 109.96 175.028 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.412 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -67.15 -34.91 78.58 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.993 0.917 . . . . 0.0 111.709 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.461 HD23 HD12 ' A' ' 76' ' ' ILE . 71.9 mt -72.75 -32.33 65.59 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.857 0.863 . . . . 0.0 110.821 177.099 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.57 -27.64 63.29 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.875 0.87 . . . . 0.0 110.785 174.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.426 ' HG2' ' O ' ' A' ' 71' ' ' ALA . 5.7 mmp_? -69.06 -42.48 76.2 Favored 'General case' 0 C--N 1.353 0.75 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 172.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.461 HD12 HD23 ' A' ' 73' ' ' LEU . 71.1 mt -64.68 -41.36 92.0 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 C-N-CA 123.206 0.602 . . . . 0.0 110.367 177.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -59.37 -38.81 81.39 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.027 0.931 . . . . 0.0 111.292 178.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.532 ' HB3' HG23 ' A' ' 80' ' ' THR . 35.5 t -87.05 -13.9 43.04 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 115.027 -0.988 . . . . 0.0 111.226 178.279 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 78.75 8.15 87.88 Favored Glycine 0 C--N 1.348 1.25 0 C-N-CA 123.177 0.417 . . . . 0.0 113.441 -176.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.532 HG23 ' HB3' ' A' ' 78' ' ' SER . 13.5 t -101.4 24.58 9.41 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.708 1.203 . . . . 0.0 110.065 -178.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -61.89 152.87 30.66 Favored 'General case' 0 C--N 1.35 0.595 0 C-N-CA 123.222 0.609 . . . . 0.0 110.351 170.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.521 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 70.39 21.39 77.42 Favored Glycine 0 C--N 1.344 0.984 0 CA-C-N 115.639 -0.71 . . . . 0.0 112.476 -176.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 30.9 m -118.23 113.89 22.19 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.471 0.709 . . . . 0.0 109.69 178.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 52.7 t -72.93 90.12 1.45 Allowed 'General case' 0 C--O 1.238 0.472 0 C-N-CA 123.438 0.695 . . . . 0.0 109.517 171.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 29.5 m -61.22 -23.03 28.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 124.411 1.084 . . . . 0.0 112.756 -176.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.409 ' HD3' ' HB3' ' A' ' 108' ' ' CYS . 54.5 tttm -64.71 -27.2 68.75 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.305 0.642 . . . . 0.0 111.588 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.451 ' SG ' ' HB2' ' A' ' 89' ' ' LYS . 30.7 p -136.14 4.12 2.94 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 112.038 0.384 . . . . 0.0 112.038 -179.252 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 63.06 30.89 78.87 Favored Glycine 0 C--N 1.349 1.264 0 O-C-N 123.128 0.267 . . . . 0.0 113.723 -178.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.451 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 11.5 mmmm -106.88 172.08 7.01 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.806 0.842 . . . . 0.0 110.462 -179.568 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.521 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 15.2 tpp180 -90.92 128.4 36.76 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.126 0.97 . . . . 0.0 109.651 177.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 9.2 mm -64.91 142.4 16.97 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 171.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 19.6 m -74.26 150.72 40.11 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 122.847 0.459 . . . . 0.0 109.774 177.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -61.96 -37.14 83.64 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 122.919 0.488 . . . . 0.0 110.287 175.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -62.17 -45.87 91.46 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 124.115 0.966 . . . . 0.0 110.755 176.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.423 ' HG3' HG22 ' A' ' 102' ' ' THR . 28.3 tpt180 -60.85 -40.62 93.57 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.405 175.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 82.0 mt -69.75 -38.45 76.81 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.508 0.723 . . . . 0.0 112.184 -178.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -79.18 -30.95 43.69 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 122.372 0.269 . . . . 0.0 110.42 -174.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -80.06 -39.28 30.08 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.806 0.842 . . . . 0.0 110.641 177.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.5 p -148.48 92.3 4.54 Favored Pre-proline 0 CA--C 1.556 1.196 0 C-N-CA 124.33 1.052 . . . . 0.0 109.49 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.06 -17.3 31.82 Favored 'Trans proline' 0 C--N 1.378 2.086 0 C-N-CA 122.404 2.069 . . . . 0.0 112.346 175.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 10.7 p90 -94.6 62.71 2.82 Favored 'General case' 0 C--N 1.348 0.525 0 C-N-CA 124.333 1.053 . . . . 0.0 109.092 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' THR . . . . . 0.423 HG22 ' HG3' ' A' ' 95' ' ' ARG . 12.4 t -137.54 117.08 10.19 Favored Pre-proline 0 CA--C 1.553 1.089 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.511 178.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -81.23 -7.29 12.98 Favored 'Trans proline' 0 C--N 1.368 1.568 0 C-N-CA 122.259 1.972 . . . . 0.0 111.877 169.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -116.97 143.97 45.11 Favored 'General case' 0 C--N 1.356 0.858 0 C-N-CA 123.465 0.706 . . . . 0.0 110.162 -175.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.4 ' SG ' ' HB2' ' A' ' 107' ' ' GLU . 30.6 p -80.89 164.25 22.77 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 174.697 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -51.31 -37.77 49.34 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.791 0.837 . . . . 0.0 111.705 -178.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.4 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 37.5 mt-10 -54.88 -53.59 53.48 Favored 'General case' 0 CA--C 1.55 0.957 0 O-C-N 124.378 1.049 . . . . 0.0 110.74 175.533 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.409 ' HB3' ' HD3' ' A' ' 86' ' ' LYS . 87.8 m -71.35 -34.24 70.33 Favored 'General case' 0 N--CA 1.482 1.141 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.68 -176.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -63.28 -38.85 92.75 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.718 0.807 . . . . 0.0 110.546 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -77.34 -25.94 51.57 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.802 0.841 . . . . 0.0 111.108 176.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.551 1.012 0 C-N-CA 123.898 0.879 . . . . 0.0 111.976 -176.768 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 . . . . . 0 N--CA 1.475 0.82 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 90.6 t -54.92 -41.81 60.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 CA-C-N 114.675 -1.148 . . . . 0.0 111.966 -172.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -61.07 -39.22 89.07 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.708 0.803 . . . . 0.0 111.732 -177.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 17.7 m -62.5 -42.2 99.34 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.379 0.672 . . . . 0.0 110.013 177.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.463 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 26.4 m-85 -71.6 -33.02 68.64 Favored 'General case' 0 C--O 1.213 -0.844 0 CA-C-N 114.558 -1.201 . . . . 0.0 110.788 179.066 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -67.42 -53.13 31.75 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 124.047 0.939 . . . . 0.0 110.523 -175.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -63.13 -43.32 98.69 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.416 -179.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.488 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 13.7 tt -65.24 -33.4 63.42 Favored 'Isoleucine or valine' 0 C--N 1.363 1.16 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 -177.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.533 ' HB3' HG21 ' A' ' 69' ' ' ILE . 61.2 mt -67.17 -36.82 82.61 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.127 0.571 . . . . 0.0 111.402 177.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 19.8 mtm180 -63.79 -41.49 97.92 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 123.279 0.362 . . . . 0.0 110.856 176.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -69.78 -40.25 76.15 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.028 0.531 . . . . 0.0 111.468 -179.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.488 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -63.99 -50.34 68.92 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.442 0.697 . . . . 0.0 110.276 178.621 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.572 ' HB3' HG23 ' A' ' 69' ' ' ILE . 2.9 pt20 -64.71 -31.56 72.83 Favored 'General case' 0 C--O 1.213 -0.864 0 CA-C-O 119.248 -0.406 . . . . 0.0 110.494 -178.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 29.6 mtt85 -68.68 -51.03 46.2 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.43 0.692 . . . . 0.0 112.129 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -61.37 -35.1 76.53 Favored 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 178.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.548 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 95.6 mt -67.0 -45.47 77.51 Favored 'General case' 0 C--O 1.215 -0.75 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.674 173.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -60.62 -47.24 87.1 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.883 0.873 . . . . 0.0 111.954 -173.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 9.0 ptp180 -66.72 -35.43 80.11 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 122.637 0.375 . . . . 0.0 110.273 176.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -63.5 -43.63 96.69 Favored 'General case' 0 C--N 1.362 1.11 0 C-N-CA 123.709 0.804 . . . . 0.0 112.031 178.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 2.7 pp -86.09 -21.23 27.76 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 122.977 0.511 . . . . 0.0 111.319 -176.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 57.6 m-70 . . . . . 0 N--CA 1.484 1.25 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 171.189 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.469 HD13 HD11 ' A' ' 27' ' ' LEU . 19.1 mt . . . . . 0 CA--C 1.54 0.594 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 119.82 146.1 7.66 Favored Glycine 0 N--CA 1.475 1.278 0 CA-C-O 119.253 -0.749 . . . . 0.0 111.651 177.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 60.3 tt0 -58.08 -50.9 71.84 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.047 0.939 . . . . 0.0 111.892 -173.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 7.1 p -54.74 -38.79 44.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 123.71 0.804 . . . . 0.0 111.402 179.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -71.3 -53.5 10.3 Favored Glycine 0 C--N 1.346 1.124 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.797 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -65.46 -38.11 88.86 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 124.249 1.02 . . . . 0.0 111.534 -175.065 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -69.13 -43.29 74.68 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.889 0.876 . . . . 0.0 110.252 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -70.41 -35.64 73.55 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.577 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.3 mp -63.15 -39.59 95.1 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.215 1.006 . . . . 0.0 110.792 175.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 52.6 ttt180 -59.89 -45.7 91.7 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.932 0.893 . . . . 0.0 110.026 175.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.494 ' HB2' ' O ' ' A' ' 101' ' ' TYR . . . -64.87 -44.79 88.53 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 114.713 -1.131 . . . . 0.0 111.922 -178.272 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.572 HG23 ' HB3' ' A' ' 20' ' ' GLN . 83.3 mt -70.74 -44.64 76.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 123.581 0.752 . . . . 0.0 110.81 -178.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -68.2 -37.48 80.95 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.365 0.666 . . . . 0.0 110.835 -175.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.454 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -64.93 -43.08 93.95 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.795 0.684 . . . . 0.0 110.232 176.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.428 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -62.09 -45.5 93.22 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 123.884 0.74 . . . . 0.0 110.996 177.649 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.515 HD22 HD12 ' A' ' 76' ' ' ILE . 86.2 mt -63.31 -34.92 78.73 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 124.263 1.025 . . . . 0.0 111.589 176.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.44 -35.92 81.51 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.464 0.706 . . . . 0.0 110.711 177.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.454 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 52.6 mtp85 -72.77 -29.09 63.01 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.987 176.511 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.515 HD12 HD22 ' A' ' 73' ' ' LEU . 84.0 mt -66.99 -44.08 88.68 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 122.574 0.35 . . . . 0.0 110.084 176.252 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.1 -35.23 80.48 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.521 0.729 . . . . 0.0 111.119 177.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.42 ' HB3' HG21 ' A' ' 80' ' ' THR . 32.4 t -79.64 -19.8 48.28 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 123.604 0.762 . . . . 0.0 111.358 177.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 80.58 12.1 83.31 Favored Glycine 0 C--N 1.351 1.365 0 C-N-CA 123.034 0.349 . . . . 0.0 113.6 -178.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.42 HG21 ' HB3' ' A' ' 78' ' ' SER . 10.2 t -110.28 21.54 16.59 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 124.279 1.032 . . . . 0.0 110.781 179.558 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 75.6 t80 -60.14 145.26 47.51 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.118 0.567 . . . . 0.0 111.595 171.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 75.11 38.53 39.83 Favored Glycine 0 C--N 1.348 1.247 0 O-C-N 124.016 0.823 . . . . 0.0 111.926 -176.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 40.5 m -127.78 117.9 22.73 Favored 'General case' 0 C--O 1.243 0.731 0 C-N-CA 124.014 0.926 . . . . 0.0 109.16 175.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 51.2 t -61.49 102.7 0.26 Allowed 'General case' 0 C--N 1.351 0.649 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 169.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 23.1 m -56.69 -38.42 57.73 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 C-N-CA 124.312 1.045 . . . . 0.0 111.562 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -68.77 -21.65 64.34 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.07 0.948 . . . . 0.0 111.361 -177.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 59.9 m -105.24 -29.65 10.18 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.398 0.679 . . . . 0.0 111.962 178.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 66.34 32.08 80.89 Favored Glycine 0 CA--C 1.536 1.35 0 N-CA-C 111.624 -0.59 . . . . 0.0 111.624 -161.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -130.73 -178.44 4.8 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.971 0.909 . . . . 0.0 110.999 -174.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 25.8 mmm180 -71.99 159.95 33.35 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.832 0.853 . . . . 0.0 113.17 -175.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 39.2 mm -106.93 147.0 12.62 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 CA-C-N 114.521 -1.218 . . . . 0.0 108.196 163.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 13.2 m -73.97 149.78 41.14 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.418 0.687 . . . . 0.0 110.252 178.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -58.8 -45.16 90.56 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.48 0.712 . . . . 0.0 110.23 175.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.419 ' HA ' ' HE3' ' A' ' 97' ' ' LYS . 38.0 m-20 -65.32 -31.87 73.23 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.457 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.514 ' HA ' ' HE ' ' A' ' 95' ' ' ARG . 2.1 tpm_? -70.79 -40.75 72.37 Favored 'General case' 0 C--O 1.216 -0.687 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.095 175.278 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 79.5 mt -70.63 -39.53 73.63 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.377 0.671 . . . . 0.0 111.723 -178.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.419 ' HE3' ' HA ' ' A' ' 94' ' ' ASP . 16.0 ptpt -71.81 -31.88 67.01 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 122.684 0.394 . . . . 0.0 110.312 -176.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -77.17 -58.24 3.39 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.073 0.549 . . . . 0.0 110.386 174.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.6 p -130.98 95.2 26.06 Favored Pre-proline 0 CA--C 1.562 1.427 0 C-N-CA 124.81 1.244 . . . . 0.0 109.857 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -80.14 -11.66 13.37 Favored 'Trans proline' 0 C--N 1.378 2.106 0 C-N-CA 122.71 2.273 . . . . 0.0 112.929 177.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . 0.494 ' O ' ' HB2' ' A' ' 68' ' ' ALA . 10.2 p90 -95.74 36.29 1.3 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.329 0.651 . . . . 0.0 111.069 179.678 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 15.0 t -106.78 120.26 48.79 Favored Pre-proline 0 CA--C 1.555 1.159 0 O-C-N 122.088 -0.382 . . . . 0.0 110.506 177.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -78.41 -9.37 16.22 Favored 'Trans proline' 0 C--N 1.376 2.013 0 C-N-CA 122.361 2.04 . . . . 0.0 112.097 168.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.407 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 14.9 m-85 -118.13 159.04 23.96 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.043 0.537 . . . . 0.0 110.465 -174.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 31.1 p -85.81 169.5 13.3 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 174.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.492 ' HB2' ' HD2' ' A' ' 95' ' ' ARG . 36.1 tt0 -59.32 -28.39 66.77 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 122.985 0.514 . . . . 0.0 111.439 -176.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -70.04 -47.17 63.14 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.319 1.048 . . . . 0.0 109.851 -178.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.407 ' HB2' ' HB3' ' A' ' 104' ' ' PHE . 94.0 m -68.44 -36.08 78.52 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.1 175.37 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -62.8 -36.58 83.61 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.161 0.985 . . . . 0.0 111.058 178.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.29 -33.74 70.01 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.575 174.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.548 0.896 0 C-N-CA 123.67 0.788 . . . . 0.0 112.84 -179.677 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 N--CA 1.477 0.902 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 22.8 t -63.33 -37.68 80.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.959 -173.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -58.47 -41.16 84.62 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 124.192 0.933 . . . . 0.0 110.845 -178.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.3 m -58.54 -47.24 84.87 Favored 'General case' 0 C--N 1.351 0.654 0 O-C-N 124.097 0.873 . . . . 0.0 110.611 176.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 51.8 m-85 -67.87 -37.72 82.16 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 124.335 1.022 . . . . 0.0 111.361 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.451 ' O ' ' HG3' ' A' ' 17' ' ' ARG . 2.4 tm-20 -60.97 -56.49 20.45 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.29 1.036 . . . . 0.0 110.145 -176.177 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -72.13 -35.65 69.18 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.048 -175.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.439 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 11.4 tt -66.72 -33.9 66.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 CA-C-N 118.368 0.531 . . . . 0.0 110.128 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.491 ' HB3' HG21 ' A' ' 69' ' ' ILE . 64.0 mt -67.48 -38.32 84.2 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 122.964 0.506 . . . . 0.0 110.557 174.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.492 ' O ' ' HG2' ' A' ' 21' ' ' ARG . 15.5 mtm180 -64.79 -46.05 83.67 Favored 'General case' 0 C--N 1.353 0.732 0 O-C-N 123.314 0.384 . . . . 0.0 110.29 176.362 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.78 -46.76 88.15 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.527 0.731 . . . . 0.0 111.058 -177.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.439 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -65.74 -41.11 92.55 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.637 178.933 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.636 ' HB3' HG23 ' A' ' 69' ' ' ILE . 1.4 pt20 -67.12 -36.86 82.81 Favored 'General case' 0 C--O 1.206 -1.207 0 CA-C-O 118.937 -0.554 . . . . 0.0 110.091 -179.444 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.492 ' HG2' ' O ' ' A' ' 17' ' ' ARG . 4.2 mmp_? -61.12 -50.37 73.49 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 118.18 0.445 . . . . 0.0 110.899 -178.056 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -64.64 -33.37 75.77 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 123.511 0.507 . . . . 0.0 111.461 177.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.543 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 77.6 mt -77.35 -31.89 54.73 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 122.967 0.507 . . . . 0.0 112.105 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.43 ' HD1' ' O ' ' A' ' 20' ' ' GLN . 3.6 m-85 -65.51 -48.58 72.04 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -179.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 20.6 ptt180 -73.02 -26.11 61.2 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.137 178.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 38.4 ttm-85 -59.1 -56.86 16.73 Favored 'General case' 0 C--N 1.36 1.059 0 C-N-CA 123.234 0.614 . . . . 0.0 110.513 173.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 2.4 pp -82.05 -24.63 35.2 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -173.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 . . . . . 0 N--CA 1.486 1.359 0 C-N-CA 123.243 0.617 . . . . 0.0 109.892 171.985 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.457 HD21 HD11 ' A' ' 27' ' ' LEU . 79.1 mt . . . . . 0 CA--C 1.54 0.587 0 N-CA-C 111.857 0.318 . . . . 0.0 111.857 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 119.61 124.84 3.28 Favored Glycine 0 N--CA 1.472 1.096 0 N-CA-C 110.641 -0.984 . . . . 0.0 110.641 -175.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -58.65 -49.71 76.52 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 124.389 1.076 . . . . 0.0 112.734 -167.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.424 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 8.4 p -57.1 -42.74 80.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 O-C-N 124.004 0.815 . . . . 0.0 111.545 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.41 -38.63 70.07 Favored Glycine 0 C--N 1.348 1.199 0 O-C-N 123.82 0.7 . . . . 0.0 112.822 -177.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -63.75 -48.47 76.85 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.615 0.766 . . . . 0.0 111.488 -178.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -72.14 -23.57 61.32 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.869 179.415 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.424 ' HB2' ' O ' ' A' ' 61' ' ' VAL . 12.8 tt0 -74.97 -39.26 61.39 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 176.302 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 7.2 mp -63.67 -43.14 97.57 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.841 0.856 . . . . 0.0 110.153 173.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -60.5 -39.68 88.6 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 123.68 0.612 . . . . 0.0 109.881 179.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.12 -38.57 75.61 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.901 0.88 . . . . 0.0 111.636 178.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.636 HG23 ' HB3' ' A' ' 20' ' ' GLN . 78.5 mt -69.88 -57.61 7.76 Favored 'Isoleucine or valine' 0 C--N 1.363 1.153 0 C-N-CA 123.172 0.589 . . . . 0.0 110.765 -179.216 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -62.71 -28.95 70.3 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.368 1.067 . . . . 0.0 111.739 -178.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.439 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -69.05 -44.16 73.2 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 122.705 0.402 . . . . 0.0 110.037 172.206 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -66.11 -32.32 73.71 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.817 0.847 . . . . 0.0 111.274 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 90.4 mt -70.7 -37.31 73.57 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.963 0.905 . . . . 0.0 110.254 174.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.57 -26.91 65.64 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.758 0.823 . . . . 0.0 111.229 174.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.439 ' HG2' ' O ' ' A' ' 71' ' ' ALA . 5.7 mmp_? -70.32 -40.2 74.32 Favored 'General case' 0 C--N 1.357 0.908 0 C-N-CA 122.997 0.519 . . . . 0.0 109.799 173.486 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 81.8 mt -66.12 -43.42 92.21 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.243 0 C-N-CA 123.397 0.679 . . . . 0.0 110.292 178.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.29 -39.88 94.41 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.261 1.025 . . . . 0.0 110.775 178.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.433 ' HB3' HG23 ' A' ' 80' ' ' THR . 47.1 t -77.13 -24.73 51.62 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.677 0.791 . . . . 0.0 111.299 177.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 86.82 13.42 66.95 Favored Glycine 0 C--N 1.347 1.177 0 C-N-CA 123.169 0.414 . . . . 0.0 113.045 -176.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.433 HG23 ' HB3' ' A' ' 78' ' ' SER . 14.8 t -110.84 24.38 13.01 Favored 'General case' 0 CA--C 1.557 1.215 0 C-N-CA 124.329 1.051 . . . . 0.0 110.825 -179.087 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -70.95 142.92 51.03 Favored 'General case' 0 N--CA 1.477 0.913 0 O-C-N 121.977 -0.452 . . . . 0.0 109.95 168.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 77.29 26.97 60.56 Favored Glycine 0 C--N 1.346 1.098 0 O-C-N 123.903 0.752 . . . . 0.0 111.741 -173.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 49.3 m -122.77 119.71 31.42 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 124.142 0.977 . . . . 0.0 110.028 177.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . 0.765 ' SG ' ' SG ' ' A' ' 105' ' ' CYS . 29.5 t -63.07 94.06 0.07 Allowed 'General case' 0 C--N 1.349 0.572 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 166.581 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 34.8 m -64.98 -25.73 38.4 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 C-N-CA 124.146 0.978 . . . . 0.0 111.248 -174.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.554 ' HD3' ' HB3' ' A' ' 108' ' ' CYS . 57.7 tttm -73.94 -14.64 61.08 Favored 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 124.723 1.209 . . . . 0.0 112.159 -177.342 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.681 ' SG ' ' SG ' ' A' ' 84' ' ' CYS . 4.3 m -132.31 -21.0 2.35 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -175.926 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 69.95 52.62 18.3 Favored Glycine 0 C--N 1.347 1.173 0 O-C-N 123.228 0.33 . . . . 0.0 112.623 -169.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.523 ' HG2' ' HB2' ' A' ' 87' ' ' CYS . 19.5 ptpt -143.88 -167.97 2.73 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.547 0.739 . . . . 0.0 109.558 176.179 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.3 mmm180 -76.65 160.85 29.03 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.962 0.905 . . . . 0.0 113.411 -178.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 19.1 mm -104.57 144.18 14.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 114.342 -1.299 . . . . 0.0 107.542 159.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.8 p -73.93 152.97 40.0 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.589 0.756 . . . . 0.0 110.767 176.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -68.45 -36.95 79.75 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.064 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -59.35 -40.4 86.26 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.031 0.933 . . . . 0.0 111.159 175.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 29.4 tpt180 -64.06 -45.32 89.31 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.143 175.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 95.7 mt -71.02 -32.92 69.83 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.407 0.683 . . . . 0.0 112.763 -175.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.3 ptpt -81.75 -27.43 33.82 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.489 0.315 . . . . 0.0 110.433 -177.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -78.43 -43.82 26.3 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.588 0.755 . . . . 0.0 110.493 174.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.7 p -152.86 95.38 3.03 Favored Pre-proline 0 CA--C 1.557 1.23 0 C-N-CA 124.478 1.111 . . . . 0.0 109.2 -176.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -74.44 -9.82 21.8 Favored 'Trans proline' 0 C--N 1.376 2.014 0 C-N-CA 122.615 2.21 . . . . 0.0 112.487 175.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 11.1 p90 -102.92 67.01 0.94 Allowed 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.206 1.002 . . . . 0.0 108.965 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 10.4 t -140.92 117.91 7.74 Favored Pre-proline 0 CA--C 1.551 0.983 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.575 177.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.23 -24.34 23.33 Favored 'Trans proline' 0 C--N 1.373 1.838 0 C-N-CA 122.262 1.975 . . . . 0.0 111.8 173.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -105.54 144.82 31.77 Favored 'General case' 0 C--N 1.352 0.713 0 CA-C-O 122.305 1.05 . . . . 0.0 111.133 -176.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.836 ' SG ' ' HB2' ' A' ' 108' ' ' CYS . 3.5 p -64.3 164.97 10.25 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 113.628 -1.624 . . . . 0.0 110.556 167.648 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.2 tt0 -55.34 -51.82 65.5 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 123.895 0.878 . . . . 0.0 112.367 -174.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.56 -29.82 52.34 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -174.569 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.836 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 75.7 m -78.34 -25.61 46.48 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.358 0.263 . . . . 0.0 111.366 177.072 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.05 -35.45 69.33 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 123.705 0.628 . . . . 0.0 109.878 169.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.38 -29.09 63.44 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.82 0.848 . . . . 0.0 112.054 178.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.907 0 C-N-CA 123.689 0.796 . . . . 0.0 111.462 -174.455 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 55.4 t30 . . . . . 0 C--O 1.246 0.906 0 CA-C-O 122.154 0.978 . . . . 0.0 110.121 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 81.7 t -65.5 -32.44 58.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 CA-C-N 114.238 -1.346 . . . . 0.0 111.135 -177.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -59.58 -36.34 76.05 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.191 0.996 . . . . 0.0 112.599 -176.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 71.9 m -69.88 -39.21 76.43 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 122.715 0.406 . . . . 0.0 111.064 176.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -68.99 -34.27 75.03 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.098 0.559 . . . . 0.0 110.043 175.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -63.22 -56.23 18.38 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.749 1.22 . . . . 0.0 109.259 -177.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.444 ' NZ ' ' HB2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -67.61 -39.84 84.71 Favored 'General case' 0 C--O 1.219 -0.545 0 CA-C-N 115.696 -0.683 . . . . 0.0 112.164 -175.057 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 13.5 tt -64.98 -31.77 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 CA-C-O 120.965 0.412 . . . . 0.0 110.242 -177.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.58 ' HB3' HG23 ' A' ' 69' ' ' ILE . 64.4 mt -69.63 -42.0 74.89 Favored 'General case' 0 C--N 1.349 0.556 0 C-N-CA 123.368 0.667 . . . . 0.0 110.847 174.084 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.487 ' O ' ' HG2' ' A' ' 21' ' ' ARG . 1.8 mmp_? -61.67 -46.35 90.1 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 123.388 0.675 . . . . 0.0 110.361 177.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -59.11 -47.34 85.61 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.583 0.753 . . . . 0.0 110.551 178.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -66.43 -41.27 89.44 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 114.806 -1.088 . . . . 0.0 111.544 -176.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.604 ' HB3' HG22 ' A' ' 69' ' ' ILE . 2.8 pt20 -71.68 -32.99 68.44 Favored 'General case' 0 C--O 1.212 -0.918 0 CA-C-O 118.525 -0.75 . . . . 0.0 110.673 -177.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.487 ' HG2' ' O ' ' A' ' 17' ' ' ARG . 22.9 mmt180 -67.6 -46.81 71.5 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.192 0.597 . . . . 0.0 110.826 -177.437 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -66.54 -32.88 74.5 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.871 178.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.533 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 89.4 mt -77.58 -32.24 53.57 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-O 118.631 -0.7 . . . . 0.0 111.842 176.364 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -58.54 -54.46 46.75 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 123.239 0.616 . . . . 0.0 109.507 178.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.5 ptt180 -72.83 -25.84 61.27 Favored 'General case' 0 CA--C 1.549 0.913 0 CA-C-N 114.832 -1.076 . . . . 0.0 111.522 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 52.3 ttm-85 -63.15 -52.08 63.89 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.022 0.529 . . . . 0.0 112.102 175.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.605 HD23 HD22 ' A' ' 66' ' ' LEU . 2.9 pp -81.44 -25.67 35.94 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 122.334 -0.229 . . . . 0.0 111.02 -178.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 6.1 m170 . . . . . 0 N--CA 1.486 1.366 0 C-N-CA 122.952 0.501 . . . . 0.0 110.594 169.206 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 12.5 mt . . . . . 0 C--O 1.241 0.63 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -60.79 130.74 48.38 Favored Glycine 0 C--N 1.346 1.085 0 CA-C-O 119.074 -0.848 . . . . 0.0 111.906 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -64.29 -43.2 95.48 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.244 0.617 . . . . 0.0 111.104 -174.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 7.8 p -58.9 -35.04 54.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 123.199 0.6 . . . . 0.0 110.958 173.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.43 -43.71 76.82 Favored Glycine 0 C--N 1.345 1.082 0 O-C-N 123.647 0.592 . . . . 0.0 112.205 175.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -67.5 -47.87 68.75 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 124.024 0.93 . . . . 0.0 111.554 -176.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -67.66 -39.3 84.55 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.445 0.698 . . . . 0.0 110.806 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.4 ' O ' HG13 ' A' ' 69' ' ' ILE . 24.7 tt0 -70.75 -33.17 70.53 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 123.44 0.463 . . . . 0.0 110.129 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.605 HD22 HD23 ' A' ' 27' ' ' LEU . 2.5 mp -66.18 -41.33 90.43 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.344 0.658 . . . . 0.0 110.791 173.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 56.4 ttt180 -58.05 -42.96 86.55 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 123.656 0.597 . . . . 0.0 109.62 175.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.02 -39.71 75.65 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.42 1.088 . . . . 0.0 111.919 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.604 HG22 ' HB3' ' A' ' 20' ' ' GLN . 72.9 mt -68.69 -54.08 23.15 Favored 'Isoleucine or valine' 0 C--N 1.359 1.012 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -178.488 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -67.09 -23.27 65.83 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.331 1.052 . . . . 0.0 112.605 179.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.468 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -65.85 -54.56 25.1 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 170.505 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.482 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -58.81 -42.38 89.03 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 124.448 1.092 . . . . 0.0 111.339 -178.361 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.494 HD22 HD12 ' A' ' 76' ' ' ILE . 95.5 mt -68.04 -38.42 82.49 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.319 1.047 . . . . 0.0 111.721 179.469 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.34 -33.0 74.93 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.173 0.589 . . . . 0.0 110.394 174.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.468 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 80.5 mtt-85 -74.91 -27.4 60.2 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.588 0.755 . . . . 0.0 111.36 177.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.494 HD12 HD22 ' A' ' 73' ' ' LEU . 76.2 mt -69.89 -44.6 78.63 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 174.129 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.37 -32.97 74.88 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 114.825 -1.08 . . . . 0.0 111.324 176.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 26.6 t -84.08 -23.2 30.91 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.439 0.696 . . . . 0.0 111.627 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 86.95 16.63 60.86 Favored Glycine 0 C--N 1.35 1.31 0 O-C-N 123.298 0.374 . . . . 0.0 113.785 -178.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.4 t -114.36 18.83 16.68 Favored 'General case' 0 CA--C 1.559 1.291 0 C-N-CA 124.111 0.964 . . . . 0.0 111.372 178.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -72.66 137.61 46.15 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 170.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.444 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 88.5 11.42 66.37 Favored Glycine 0 CA--C 1.528 0.857 0 O-C-N 123.987 0.804 . . . . 0.0 111.918 -171.444 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 22.7 m -118.79 118.2 30.95 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.511 0.724 . . . . 0.0 109.656 175.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 46.5 t -74.2 92.84 2.26 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.898 171.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 27.0 m -66.84 -14.45 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 124.041 0.936 . . . . 0.0 112.755 -177.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 47.7 tttm -76.49 -17.41 59.3 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.152 0.581 . . . . 0.0 111.844 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 31.0 p -144.26 8.6 1.4 Allowed 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 176.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 62.43 32.38 82.82 Favored Glycine 0 C--N 1.358 1.759 0 C-N-CA 123.247 0.451 . . . . 0.0 114.196 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 32.3 mmmt -116.05 -171.39 1.98 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.499 0.72 . . . . 0.0 110.067 -176.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.444 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 24.2 tpp180 -89.12 151.42 22.22 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.176 0.991 . . . . 0.0 110.364 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 9.8 mm -92.5 138.74 19.32 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 165.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 39.0 m -73.92 151.38 40.41 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 122.619 0.368 . . . . 0.0 110.54 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -61.36 -41.43 97.06 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.405 0.682 . . . . 0.0 109.896 174.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.412 ' HA ' ' HG2' ' A' ' 97' ' ' LYS . 64.0 m-20 -67.13 -33.58 75.75 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.286 178.369 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.44 ' HG3' HG21 ' A' ' 102' ' ' THR . 1.0 OUTLIER -66.43 -44.1 83.81 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.42 0.688 . . . . 0.0 109.583 174.918 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 79.4 mt -71.19 -36.01 71.78 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.764 0.826 . . . . 0.0 112.037 -177.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.412 ' HG2' ' HA ' ' A' ' 94' ' ' ASP . 16.0 ptpt -77.08 -28.18 54.52 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 110.256 -0.275 . . . . 0.0 110.256 -177.715 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -79.12 -40.48 30.95 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.493 0.717 . . . . 0.0 110.732 175.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.2 p -152.61 94.3 3.19 Favored Pre-proline 0 CA--C 1.556 1.183 0 C-N-CA 124.625 1.17 . . . . 0.0 108.79 -176.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.98 -13.1 19.54 Favored 'Trans proline' 0 C--N 1.375 1.935 0 C-N-CA 122.61 2.207 . . . . 0.0 113.816 -179.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 36.2 p90 -90.69 7.71 38.12 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -179.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' THR . . . . . 0.44 HG21 ' HG3' ' A' ' 95' ' ' ARG . 15.0 t -82.74 123.77 77.9 Favored Pre-proline 0 CA--C 1.562 1.418 0 CA-C-N 118.112 0.415 . . . . 0.0 110.735 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -84.29 0.63 9.09 Favored 'Trans proline' 0 C--N 1.368 1.605 0 C-N-CA 122.61 2.207 . . . . 0.0 111.645 167.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -117.39 141.63 48.09 Favored 'General case' 0 C--N 1.353 0.744 0 C-N-CA 123.929 0.892 . . . . 0.0 110.577 -173.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.634 ' SG ' ' HG3' ' A' ' 107' ' ' GLU . 19.8 p -80.18 173.48 12.56 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 174.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -60.96 -35.08 75.84 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -172.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.634 ' HG3' ' SG ' ' A' ' 105' ' ' CYS . 0.0 OUTLIER -72.24 -32.64 66.88 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 178.48 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 91.8 m -73.87 -38.8 64.31 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 122.452 0.301 . . . . 0.0 110.784 173.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.91 -32.54 74.3 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.129 0.972 . . . . 0.0 111.187 175.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.25 -33.45 69.83 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.74 0.816 . . . . 0.0 110.708 174.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.835 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.852 177.799 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 16.7 m120 . . . . . 0 N--CA 1.486 1.369 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 37.7 t -50.04 -42.38 19.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 C-N-CA 124.535 1.134 . . . . 0.0 111.817 178.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -70.62 -36.17 73.33 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 123.855 0.722 . . . . 0.0 111.925 -175.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 57.5 m -68.3 -35.77 78.33 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 173.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -70.3 -36.47 74.35 Favored 'General case' 0 C--O 1.215 -0.758 0 C-N-CA 123.252 0.621 . . . . 0.0 110.403 176.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -63.31 -52.19 62.92 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.207 1.003 . . . . 0.0 110.303 -175.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.82 -42.3 95.09 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.471 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.51 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 10.6 tt -69.2 -32.76 55.1 Favored 'Isoleucine or valine' 0 C--N 1.365 1.261 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 -177.039 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.444 ' HB3' HG21 ' A' ' 69' ' ' ILE . 52.8 mt -62.78 -41.87 99.44 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 122.793 0.437 . . . . 0.0 110.451 175.438 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.513 ' O ' ' HG2' ' A' ' 21' ' ' ARG . 17.4 mtm180 -60.83 -52.62 64.28 Favored 'General case' 0 C--O 1.215 -0.737 0 O-C-N 123.626 0.579 . . . . 0.0 109.448 175.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -53.95 -44.86 71.06 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.43 0.692 . . . . 0.0 111.422 -176.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.51 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -61.44 -51.21 69.67 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 124.306 1.004 . . . . 0.0 110.867 178.956 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.616 ' HB3' HG23 ' A' ' 69' ' ' ILE . 1.8 pt20 -67.83 -29.84 69.09 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 122.983 0.177 . . . . 0.0 110.941 -176.071 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.513 ' HG2' ' O ' ' A' ' 17' ' ' ARG . 29.2 mmt180 -71.41 -54.39 10.84 Favored 'General case' 0 C--N 1.354 0.781 0 C-N-CA 123.623 0.769 . . . . 0.0 110.131 -177.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -61.63 -29.93 70.37 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.109 0.564 . . . . 0.0 110.584 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.602 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 82.5 mt -69.83 -43.32 72.22 Favored 'General case' 0 C--O 1.212 -0.869 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.94 170.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.413 ' O ' ' HB2' ' A' ' 28' ' ' HIS . 2.0 m-85 -56.83 -37.15 70.84 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.099 0.56 . . . . 0.0 112.062 -177.612 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 35.7 ptt180 -80.46 -29.7 37.47 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 122.169 0.187 . . . . 0.0 111.172 174.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 47.7 ttt85 -66.83 -37.77 85.13 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.95 0.9 . . . . 0.0 112.23 177.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.602 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 1.7 pp -97.22 -35.48 10.74 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 122.473 0.309 . . . . 0.0 111.288 -177.203 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.413 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 52.1 m-70 . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 122.242 1.02 . . . . 0.0 109.341 168.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 12.4 mt . . . . . 0 N--CA 1.479 0.978 0 CA-C-O 120.596 0.236 . . . . 0.0 111.046 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -95.57 132.04 10.92 Favored Glycine 0 C--N 1.346 1.102 0 N-CA-C 110.85 -0.9 . . . . 0.0 110.85 172.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -51.62 -51.99 51.25 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 124.49 1.116 . . . . 0.0 112.906 -175.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 7.4 p -66.49 -32.15 56.75 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 C-N-CA 123.851 0.86 . . . . 0.0 111.003 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -63.46 -36.93 94.03 Favored Glycine 0 C--N 1.347 1.174 0 N-CA-C 111.903 -0.479 . . . . 0.0 111.903 175.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -76.99 -41.12 44.15 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.312 1.045 . . . . 0.0 111.552 -178.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -67.74 -39.06 84.25 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.533 0.733 . . . . 0.0 110.197 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -70.64 -39.7 73.52 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.545 178.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.1 mp -56.2 -47.2 78.84 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.024 0.929 . . . . 0.0 110.313 172.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -63.37 -37.32 86.8 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.704 0.802 . . . . 0.0 110.693 -176.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.75 -37.8 70.49 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.664 0.786 . . . . 0.0 111.182 178.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.616 HG23 ' HB3' ' A' ' 20' ' ' GLN . 85.4 mt -67.32 -52.24 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 123.973 0.909 . . . . 0.0 110.51 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.8 -29.74 70.72 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.24 1.016 . . . . 0.0 111.213 -179.17 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.4 -46.14 81.19 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 122.973 0.509 . . . . 0.0 110.043 173.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.532 ' HB1' ' HE1' ' A' ' 81' ' ' PHE . . . -66.42 -39.98 89.28 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.391 179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.497 HD22 HD12 ' A' ' 76' ' ' ILE . 68.3 mt -69.83 -32.17 70.45 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.06 0.944 . . . . 0.0 111.188 178.508 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.54 -34.82 79.14 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.348 0.659 . . . . 0.0 110.544 174.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.4 ' HA ' ' HD3' ' A' ' 75' ' ' ARG . 17.8 mmt180 -72.04 -37.95 69.63 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.501 176.71 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.497 HD12 HD22 ' A' ' 73' ' ' LEU . 59.6 mt -65.69 -41.62 90.88 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 CA-C-O 121.224 0.535 . . . . 0.0 109.629 175.636 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -67.66 -25.06 65.52 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.438 1.095 . . . . 0.0 111.933 178.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 27.5 t -100.37 2.58 42.54 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 123.739 0.816 . . . . 0.0 111.084 177.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 66.51 19.64 69.06 Favored Glycine 0 C--N 1.358 1.771 0 N-CA-C 114.452 0.541 . . . . 0.0 114.452 176.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 9.0 t -127.4 29.2 5.57 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 124.519 1.127 . . . . 0.0 110.873 -177.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.532 ' HE1' ' HB1' ' A' ' 72' ' ' ALA . 68.5 t80 -59.35 143.67 48.84 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 122.821 0.449 . . . . 0.0 110.317 167.377 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 83.48 33.63 21.93 Favored Glycine 0 C--N 1.34 0.757 0 O-C-N 123.779 0.674 . . . . 0.0 111.623 -173.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 59.1 m -125.66 120.36 30.51 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.385 0.674 . . . . 0.0 110.074 175.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . 0.419 ' HB2' ' HB3' ' A' ' 105' ' ' CYS . 48.7 t -76.66 102.18 6.06 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 123.807 0.843 . . . . 0.0 110.613 175.131 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 16.4 m -74.2 -11.45 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 124.157 0.983 . . . . 0.0 112.408 -175.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 52.4 tttm -81.03 -24.83 37.61 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.073 0.549 . . . . 0.0 111.381 -178.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.442 ' SG ' ' HB2' ' A' ' 89' ' ' LYS . 23.3 p -139.01 11.3 2.62 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 -178.487 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 62.21 26.66 67.98 Favored Glycine 0 C--N 1.353 1.512 0 N-CA-C 114.0 0.36 . . . . 0.0 114.0 -179.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.442 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 85.5 mttt -103.66 -168.89 1.56 Allowed 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.373 0.669 . . . . 0.0 110.853 -179.251 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 1.8 tmt_? -96.98 159.56 14.84 Favored 'General case' 0 CA--C 1.559 1.322 0 C-N-CA 124.796 1.239 . . . . 0.0 107.718 176.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 9.1 mm -96.25 134.21 34.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 171.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.1 m -61.73 143.64 55.89 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.476 0.711 . . . . 0.0 110.314 177.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -66.25 -38.08 87.0 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 118.104 0.411 . . . . 0.0 110.724 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -57.76 -40.1 78.95 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.489 0.715 . . . . 0.0 110.786 173.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.536 ' HG3' HG21 ' A' ' 102' ' ' THR . 25.2 tpt180 -66.32 -42.28 88.43 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.427 176.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 83.9 mt -68.93 -38.15 79.34 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.784 0.834 . . . . 0.0 112.628 -176.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -78.67 -32.16 47.04 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 122.399 0.28 . . . . 0.0 110.339 -176.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.65 -38.14 65.07 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.469 0.708 . . . . 0.0 110.749 176.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 1.7 p -155.61 99.52 2.25 Favored Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 124.773 1.229 . . . . 0.0 108.911 -178.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -73.02 -15.88 25.83 Favored 'Trans proline' 0 C--N 1.371 1.73 0 C-N-CA 122.445 2.096 . . . . 0.0 113.173 176.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 19.5 p90 -95.0 64.68 2.83 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 122.251 1.025 . . . . 0.0 109.333 179.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' THR . . . . . 0.536 HG21 ' HG3' ' A' ' 95' ' ' ARG . 13.5 t -137.94 108.53 8.32 Favored Pre-proline 0 CA--C 1.559 1.315 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.061 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.28 -8.03 18.34 Favored 'Trans proline' 0 C--N 1.371 1.757 0 C-N-CA 122.668 2.245 . . . . 0.0 112.056 169.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -104.68 140.22 38.37 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.06 0.944 . . . . 0.0 109.558 -178.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.419 ' HB3' ' HB2' ' A' ' 84' ' ' CYS . 30.3 p -78.06 169.89 17.51 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 174.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -52.67 -37.72 59.22 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 123.518 0.727 . . . . 0.0 111.067 -178.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.403 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 24.0 mt-10 -57.85 -54.56 45.58 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.316 174.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 93.2 m -70.25 -26.82 64.01 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.387 -174.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.61 -44.05 87.76 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.78 0.832 . . . . 0.0 110.151 174.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -74.48 -20.1 60.13 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.439 177.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.058 0 C-N-CA 124.107 0.963 . . . . 0.0 112.578 -177.388 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.8 m120 . . . . . 0 N--CA 1.486 1.333 0 CA-C-O 121.107 0.48 . . . . 0.0 110.166 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 72.7 t -60.55 -37.58 75.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 123.95 0.9 . . . . 0.0 111.435 -178.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -69.27 -31.84 70.63 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.142 0.577 . . . . 0.0 111.008 -179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.3 m -66.71 -39.67 88.12 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.224 0.609 . . . . 0.0 109.974 174.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -70.23 -37.57 75.01 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.257 176.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -60.4 -53.57 56.01 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.533 1.133 . . . . 0.0 110.25 -175.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -64.75 -45.04 88.14 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.758 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.441 ' O ' ' HB2' ' A' ' 19' ' ' ARG . 10.9 tt -66.11 -32.37 57.84 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.263 0 N-CA-C 110.28 -0.267 . . . . 0.0 110.28 -174.401 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.58 ' HB3' HG21 ' A' ' 69' ' ' ILE . 69.7 mt -73.27 -38.05 66.07 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.019 0.928 . . . . 0.0 111.136 177.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.597 ' HE ' HD11 ' A' ' 73' ' ' LEU . 15.2 mmt85 -64.49 -41.96 96.15 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.52 0.728 . . . . 0.0 111.109 175.267 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -69.13 -35.92 76.92 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 15' ' ' ILE . 8.4 tpt180 -65.99 -48.96 69.47 Favored 'General case' 0 C--N 1.346 0.448 0 CA-C-N 114.341 -1.3 . . . . 0.0 110.799 -177.294 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.606 ' HB3' HG23 ' A' ' 69' ' ' ILE . 2.8 pt20 -70.76 -33.83 71.2 Favored 'General case' 0 C--O 1.216 -0.696 0 CA-C-O 118.947 -0.549 . . . . 0.0 110.96 -174.194 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.447 ' HG2' ' O ' ' A' ' 17' ' ' ARG . 32.5 mmt180 -76.4 -38.39 55.72 Favored 'General case' 0 C--N 1.362 1.144 0 O-C-N 123.456 0.473 . . . . 0.0 111.951 -176.084 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -67.43 -40.72 85.48 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 177.14 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.551 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 97.1 mt -69.73 -36.25 75.69 Favored 'General case' 0 C--N 1.346 0.442 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.505 175.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.449 ' HB2' ' O ' ' A' ' 20' ' ' GLN . 0.2 OUTLIER -58.61 -54.74 43.63 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.84 0.856 . . . . 0.0 110.318 -178.02 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -69.11 -28.03 66.11 Favored 'General case' 0 CA--C 1.551 1.005 0 O-C-N 124.071 0.857 . . . . 0.0 110.815 -177.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 50.5 ttt85 -61.96 -55.04 33.49 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.826 0.85 . . . . 0.0 111.257 174.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.669 ' HB2' ' HA ' ' A' ' 58' ' ' LEU . 3.2 pp -82.51 -9.0 59.6 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 122.791 0.436 . . . . 0.0 111.904 -178.092 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 11.6 m170 . . . . . 0 N--CA 1.482 1.127 0 C-N-CA 123.987 0.915 . . . . 0.0 109.017 171.835 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.669 ' HA ' ' HB2' ' A' ' 27' ' ' LEU . 6.8 mp . . . . . 0 CA--C 1.539 0.553 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -77.97 149.25 34.21 Favored Glycine 0 C--N 1.346 1.117 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.784 -175.256 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -57.18 -49.35 76.25 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.551 1.141 . . . . 0.0 112.521 -175.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 9.8 p -61.06 -38.0 78.6 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.772 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.51 -51.38 31.68 Favored Glycine 0 C--N 1.348 1.23 0 O-C-N 123.704 0.628 . . . . 0.0 112.497 -179.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -64.1 -47.39 80.21 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.564 0.746 . . . . 0.0 111.235 -175.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.25 -22.86 59.14 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.751 -177.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -74.51 -44.81 49.55 Favored 'General case' 0 C--O 1.209 -1.035 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 173.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.426 HD11 ' HB2' ' A' ' 23' ' ' LEU . 5.1 mp -55.74 -43.24 76.44 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 124.122 0.969 . . . . 0.0 110.72 173.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 55.7 ttt180 -57.77 -45.93 85.28 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.252 1.021 . . . . 0.0 110.898 176.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -73.74 -33.47 64.34 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.438 -179.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.606 HG23 ' HB3' ' A' ' 20' ' ' GLN . 66.7 mt -69.18 -51.22 45.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.127 0.971 . . . . 0.0 109.226 -178.734 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -65.88 -27.04 67.92 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.182 0.993 . . . . 0.0 111.736 177.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.73 -42.82 81.26 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 122.792 0.437 . . . . 0.0 109.969 172.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.443 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -69.39 -39.71 77.82 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.773 0.829 . . . . 0.0 111.374 179.033 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.597 HD11 ' HE ' ' A' ' 17' ' ' ARG . 89.7 mt -72.68 -29.01 63.05 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.153 0.981 . . . . 0.0 110.939 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.36 -35.38 75.8 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.488 0.715 . . . . 0.0 110.164 173.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 67.2 mtm180 -64.32 -44.73 90.65 Favored 'General case' 0 C--N 1.355 0.846 0 O-C-N 123.6 0.563 . . . . 0.0 110.483 173.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.539 HD13 HD22 ' A' ' 73' ' ' LEU . 63.5 mt -63.35 -45.71 97.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 -179.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.78 -29.33 70.55 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.289 1.036 . . . . 0.0 111.717 179.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.504 ' HB3' HG22 ' A' ' 80' ' ' THR . 33.5 t -88.57 -12.3 43.1 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 123.964 0.906 . . . . 0.0 111.222 177.609 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 73.58 25.67 71.76 Favored Glycine 0 C--N 1.352 1.464 0 CA-C-N 116.768 -0.197 . . . . 0.0 112.868 -177.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.504 HG22 ' HB3' ' A' ' 78' ' ' SER . 14.7 t -123.62 25.82 8.01 Favored 'General case' 0 CA--C 1.556 1.209 0 C-N-CA 124.668 1.187 . . . . 0.0 110.375 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -66.18 140.87 58.22 Favored 'General case' 0 N--CA 1.477 0.913 0 O-C-N 121.538 -0.726 . . . . 0.0 110.232 171.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 83.63 27.6 38.28 Favored Glycine 0 C--N 1.342 0.906 0 O-C-N 123.732 0.645 . . . . 0.0 111.52 -171.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 94.3 m -116.09 122.05 44.0 Favored 'General case' 0 C--O 1.242 0.708 0 C-N-CA 123.656 0.783 . . . . 0.0 110.182 175.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . 0.743 ' SG ' ' SG ' ' A' ' 87' ' ' CYS . 13.1 t -66.51 95.96 0.35 Allowed 'General case' 0 C--N 1.348 0.528 0 C-N-CA 124.31 1.044 . . . . 0.0 108.623 173.434 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 11.8 m -63.29 -29.84 48.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 C-N-CA 123.991 0.916 . . . . 0.0 112.075 -170.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -72.09 -21.01 61.56 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.357 1.063 . . . . 0.0 111.081 -179.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.743 ' SG ' ' SG ' ' A' ' 84' ' ' CYS . 6.5 m -119.63 -16.74 8.79 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.752 0.821 . . . . 0.0 112.276 -169.201 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 56.95 47.68 85.06 Favored Glycine 0 C--N 1.355 1.591 0 N-CA-C 111.316 -0.714 . . . . 0.0 111.316 -166.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -138.84 -157.58 0.78 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.572 1.149 . . . . 0.0 110.116 -171.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 11.4 tpt180 -97.64 145.78 25.96 Favored 'General case' 0 CA--C 1.564 1.485 0 C-N-CA 124.083 0.953 . . . . 0.0 112.47 -176.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 5.4 mm -95.01 148.77 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 164.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.8 m -75.44 144.54 42.1 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 174.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -61.67 -37.64 84.83 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.082 0.553 . . . . 0.0 110.326 175.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -62.15 -38.43 88.98 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.942 0.897 . . . . 0.0 111.378 177.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.443 ' HG3' HG22 ' A' ' 102' ' ' THR . 30.3 tpt180 -64.28 -40.51 96.12 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.413 175.492 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 97.3 mt -78.15 -32.38 50.24 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 -175.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -76.11 -28.18 57.39 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -77.64 -49.56 14.29 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.538 0.735 . . . . 0.0 110.421 173.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.2 p -144.86 96.59 5.04 Favored Pre-proline 0 CA--C 1.558 1.251 0 C-N-CA 124.703 1.201 . . . . 0.0 109.139 -178.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . 0.45 ' HG2' HD21 ' A' ' 16' ' ' LEU . 55.5 Cg_endo -73.45 -23.57 17.25 Favored 'Trans proline' 0 C--N 1.378 2.123 0 C-N-CA 122.542 2.162 . . . . 0.0 113.569 -179.056 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 46.5 p90 -81.95 -2.26 50.8 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -177.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' THR . . . . . 0.443 HG22 ' HG3' ' A' ' 95' ' ' ARG . 13.8 t -68.77 122.4 84.75 Favored Pre-proline 0 CA--C 1.558 1.279 0 CA-C-N 118.373 0.533 . . . . 0.0 110.708 -179.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.39 -27.72 18.95 Favored 'Trans proline' 0 C--N 1.371 1.735 0 C-N-CA 122.199 1.933 . . . . 0.0 111.782 173.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -104.44 152.18 22.63 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.628 0.771 . . . . 0.0 110.735 -174.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.664 ' SG ' ' SG ' ' A' ' 84' ' ' CYS . 30.7 p -72.3 157.47 37.62 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 115.138 -0.937 . . . . 0.0 108.794 170.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.412 ' HB2' ' HD3' ' A' ' 95' ' ' ARG . 33.5 tt0 -51.1 -39.76 56.89 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.279 1.031 . . . . 0.0 112.16 -179.3 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -66.9 -48.32 69.08 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 124.182 0.993 . . . . 0.0 109.777 -177.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.649 ' SG ' ' SG ' ' A' ' 105' ' ' CYS . 85.0 m -82.54 -16.01 50.21 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 114.682 -1.145 . . . . 0.0 112.566 -174.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -85.23 -26.07 26.92 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.52 0.728 . . . . 0.0 109.942 171.249 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -77.59 -23.62 49.9 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.762 0.825 . . . . 0.0 110.175 170.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.886 0 C-N-CA 123.797 0.839 . . . . 0.0 111.738 174.918 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 . . . . . 0 CA--C 1.537 0.479 0 N-CA-C 110.502 -0.185 . . . . 0.0 110.502 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 55.4 t -66.54 -28.31 42.95 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 C-N-CA 123.408 0.683 . . . . 0.0 110.595 175.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -65.92 -38.9 89.88 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.968 0.907 . . . . 0.0 112.604 -176.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 60.3 p -64.48 -39.76 94.41 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 174.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -68.93 -32.56 72.26 Favored 'General case' 0 C--O 1.215 -0.74 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.184 177.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.525 ' HG2' HG23 ' A' ' 76' ' ' ILE . 1.4 tm-20 -60.31 -59.3 5.63 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.355 1.062 . . . . 0.0 109.374 -177.309 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt -66.81 -39.67 87.81 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 114.623 -1.171 . . . . 0.0 112.339 -174.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.455 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 12.5 tt -66.99 -38.43 81.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 -177.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.571 ' HB3' HG23 ' A' ' 69' ' ' ILE . 66.0 mt -67.84 -39.03 83.9 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 122.986 0.514 . . . . 0.0 111.368 178.714 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.436 ' O ' ' HG2' ' A' ' 21' ' ' ARG . 38.3 mmt180 -61.93 -48.16 81.66 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.123 0.569 . . . . 0.0 110.439 178.165 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -62.48 -40.9 98.18 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.261 0.624 . . . . 0.0 110.78 178.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.471 ' HA ' ' HG2' ' A' ' 22' ' ' GLU . 6.3 mpt_? -72.02 -38.1 69.65 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.77 0.828 . . . . 0.0 112.151 -176.423 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.479 ' HB3' HG22 ' A' ' 69' ' ' ILE . 2.5 pt20 -68.56 -33.88 74.85 Favored 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.148 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.436 ' HG2' ' O ' ' A' ' 17' ' ' ARG . 24.8 mmt180 -77.8 -30.3 51.21 Favored 'General case' 0 C--N 1.349 0.571 0 CA-C-O 118.972 -0.537 . . . . 0.0 112.159 -178.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.471 ' HG2' ' HA ' ' A' ' 19' ' ' ARG . 5.4 pt-20 -70.2 -33.82 72.17 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 174.692 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.561 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 88.1 mt -69.25 -47.58 64.28 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.404 172.315 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.458 ' O ' ' HB2' ' A' ' 28' ' ' HIS . 1.7 m-85 -56.88 -46.61 81.74 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.909 0.883 . . . . 0.0 111.137 -175.708 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.8 ptp180 -68.02 -37.0 80.89 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 122.96 0.504 . . . . 0.0 111.031 177.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.54 HH11 HD22 ' A' ' 23' ' ' LEU . 41.4 ttm180 -62.8 -43.08 99.73 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.037 0.935 . . . . 0.0 112.472 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 1.5 pp -94.67 -15.74 23.7 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.545 0.338 . . . . 0.0 111.836 -177.661 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.458 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 10.1 m170 . . . . . 0 N--CA 1.49 1.528 0 C-N-CA 123.386 0.674 . . . . 0.0 109.434 168.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.2 mt . . . . . 0 N--CA 1.473 0.712 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -79.18 151.17 34.62 Favored Glycine 0 C--N 1.348 1.242 0 CA-C-O 119.27 -0.739 . . . . 0.0 111.423 172.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -62.43 -51.67 66.62 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.26 0.624 . . . . 0.0 111.594 -176.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 8.4 p -60.74 -32.53 52.16 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 123.651 0.78 . . . . 0.0 111.21 175.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.518 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -60.5 -57.0 21.22 Favored Glycine 0 C--N 1.349 1.304 0 O-C-N 123.992 0.807 . . . . 0.0 111.439 175.542 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -63.41 -38.89 92.9 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 124.636 1.174 . . . . 0.0 111.473 -178.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -62.13 -53.25 57.98 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-N 114.85 -1.068 . . . . 0.0 109.66 -175.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -70.75 -34.23 71.64 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-N 114.044 -1.435 . . . . 0.0 109.874 -179.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' A' ' 62' ' ' GLY . 14.8 tp -60.71 -53.51 56.58 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.699 1.2 . . . . 0.0 111.001 -178.121 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 80.5 ttt180 -76.16 -29.75 57.84 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 113.742 -1.572 . . . . 0.0 110.171 -173.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.4 -47.11 80.42 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.17 0.588 . . . . 0.0 110.263 173.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.571 HG23 ' HB3' ' A' ' 16' ' ' LEU . 74.7 mt -62.34 -48.19 89.51 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.661 175.444 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -68.8 -33.29 73.61 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.358 0.663 . . . . 0.0 110.374 -172.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.9 -41.45 74.69 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.382 0.673 . . . . 0.0 109.979 175.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.473 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -61.63 -41.44 97.48 Favored 'General case' 0 N--CA 1.481 1.115 0 O-C-N 123.882 0.739 . . . . 0.0 110.948 177.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.493 HD22 HD13 ' A' ' 76' ' ' ILE . 92.5 mt -67.93 -38.1 82.46 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.695 1.198 . . . . 0.0 111.53 177.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.67 -31.68 72.82 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.707 175.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -75.12 -33.64 61.59 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.748 0.819 . . . . 0.0 111.108 176.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.525 HG23 ' HG2' ' A' ' 13' ' ' GLU . 73.0 mt -63.33 -43.04 98.41 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 174.135 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.87 -41.02 99.23 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.166 175.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.431 ' HB3' HG23 ' A' ' 80' ' ' THR . 27.2 t -83.12 -6.64 59.56 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.86 0.864 . . . . 0.0 112.095 -175.075 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.63 26.19 73.55 Favored Glycine 0 C--N 1.354 1.569 0 CA-C-O 120.962 0.201 . . . . 0.0 112.814 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.431 HG23 ' HB3' ' A' ' 78' ' ' SER . 12.4 t -130.67 27.07 4.99 Favored 'General case' 0 CA--C 1.555 1.165 0 C-N-CA 124.59 1.156 . . . . 0.0 110.417 179.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -66.17 146.21 54.9 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 166.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.533 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 73.16 33.57 59.13 Favored Glycine 0 C--O 1.216 -0.998 0 O-C-N 123.667 0.604 . . . . 0.0 111.74 -174.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 88.2 m -122.09 146.69 46.96 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.337 0.655 . . . . 0.0 109.926 176.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 41.2 t -115.47 102.17 9.57 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.738 1.215 . . . . 0.0 109.082 176.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 27.3 m -65.49 -24.96 35.74 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 C-N-CA 123.887 0.875 . . . . 0.0 113.07 -174.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.54 ' HD2' ' HB3' ' A' ' 108' ' ' CYS . 22.0 ttmm -74.46 -11.05 60.13 Favored 'General case' 0 CA--C 1.559 1.312 0 C-N-CA 123.097 0.559 . . . . 0.0 112.249 -177.032 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 28.0 p -138.92 1.85 2.1 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.882 -0.511 . . . . 0.0 111.722 171.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 59.67 31.84 72.32 Favored Glycine 0 C--N 1.356 1.66 0 O-C-N 123.526 0.517 . . . . 0.0 114.179 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 50.4 mtpt -123.88 166.39 15.74 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-N 117.105 0.452 . . . . 0.0 111.215 -174.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.533 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 14.1 tpp180 -69.42 140.57 54.14 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 124.5 1.12 . . . . 0.0 110.876 -179.376 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 17.0 mm -75.54 150.67 6.6 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 123.762 0.825 . . . . 0.0 109.058 171.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 44.3 m -70.53 145.67 50.69 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 122.873 0.469 . . . . 0.0 109.769 173.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -58.75 -40.52 84.12 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.716 0.406 . . . . 0.0 110.05 174.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.495 ' HA ' ' HE3' ' A' ' 97' ' ' LYS . 36.4 m-20 -64.59 -32.9 74.75 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 114.964 -1.016 . . . . 0.0 111.454 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 4.8 tpm_? -70.72 -40.35 72.85 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.468 176.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 98.8 mt -72.39 -35.73 68.5 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 123.598 0.561 . . . . 0.0 111.932 -177.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.495 ' HE3' ' HA ' ' A' ' 94' ' ' ASP . 15.7 ptpt -74.86 -29.72 61.11 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -77.79 -39.58 43.5 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.585 0.754 . . . . 0.0 111.099 176.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.5 p -157.37 96.27 2.06 Favored Pre-proline 0 CA--C 1.557 1.216 0 C-N-CA 124.53 1.132 . . . . 0.0 109.15 -177.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . 0.465 ' HG2' HD22 ' A' ' 16' ' ' LEU . 89.3 Cg_endo -78.53 -1.15 11.35 Favored 'Trans proline' 0 C--N 1.378 2.118 0 C-N-CA 122.796 2.331 . . . . 0.0 113.467 -179.454 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 27.1 p90 -108.6 9.81 27.19 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -178.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 12.7 t -76.78 118.47 71.96 Favored Pre-proline 0 CA--C 1.561 1.401 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 175.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -76.75 -6.34 16.78 Favored 'Trans proline' 0 C--N 1.376 1.977 0 C-N-CA 122.552 2.168 . . . . 0.0 112.377 178.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.497 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 33.0 m-85 -130.19 159.03 38.08 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.663 0.785 . . . . 0.0 109.899 -177.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 17.8 p -82.38 165.03 20.65 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 176.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.5 tm0? -49.19 -40.33 32.88 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.597 0.759 . . . . 0.0 111.712 -173.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -56.97 -54.23 49.0 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.643 0.777 . . . . 0.0 111.632 177.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.54 ' HB3' ' HD2' ' A' ' 86' ' ' LYS . 61.8 m -78.74 -22.14 46.96 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.56 -173.313 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -81.27 -33.05 32.95 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.789 0.835 . . . . 0.0 109.998 179.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -78.78 -20.26 50.26 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.674 0.79 . . . . 0.0 110.655 173.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.854 0 C-N-CA 123.669 0.787 . . . . 0.0 112.165 176.303 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 18.7 m120 . . . . . 0 N--CA 1.482 1.137 0 CA-C-O 121.195 0.521 . . . . 0.0 111.591 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 59.1 t -56.67 -28.2 27.12 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.318 0 CA-C-N 114.174 -1.375 . . . . 0.0 112.028 -173.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.8 mp0 -62.85 -43.69 98.13 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 124.75 1.22 . . . . 0.0 111.117 -174.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.9 m -61.28 -44.91 96.46 Favored 'General case' 0 C--O 1.241 0.64 0 CA-C-N 114.757 -1.111 . . . . 0.0 109.936 175.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.464 ' HA ' HG21 ' A' ' 15' ' ' ILE . 27.8 m-85 -72.83 -29.99 63.67 Favored 'General case' 0 C--O 1.215 -0.733 0 CA-C-N 114.84 -1.073 . . . . 0.0 111.332 -178.268 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.447 ' HG2' HG23 ' A' ' 76' ' ' ILE . 3.4 tm-20 -65.42 -53.07 48.38 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 125.001 1.32 . . . . 0.0 109.002 -174.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.6 ptmm? -67.32 -43.17 82.29 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 114.81 -1.087 . . . . 0.0 111.603 -179.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.464 HG21 ' HA ' ' A' ' 12' ' ' TYR . 13.2 tt -69.54 -29.45 41.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 CA-C-O 120.779 0.324 . . . . 0.0 110.891 -174.199 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.448 ' HB3' HG22 ' A' ' 69' ' ' ILE . 41.0 mt -64.15 -46.65 83.12 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.736 171.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -64.25 -38.69 91.94 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 123.424 0.453 . . . . 0.0 111.274 178.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -58.66 -51.47 69.78 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.101 0.56 . . . . 0.0 109.661 177.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -64.53 -40.22 95.21 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 124.267 0.979 . . . . 0.0 111.189 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.449 ' HB2' HG21 ' A' ' 69' ' ' ILE . 3.9 tt0 -66.11 -44.62 83.78 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.268 0.627 . . . . 0.0 111.368 -179.109 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.507 ' O ' ' HG2' ' A' ' 25' ' ' ARG . 17.9 mmt180 -76.22 -36.0 58.78 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 119.101 -0.476 . . . . 0.0 111.07 -172.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -68.57 -38.45 80.73 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 123.684 0.615 . . . . 0.0 110.144 175.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.41 HD21 ' HA2' ' A' ' 62' ' ' GLY . 67.2 mt -67.18 -40.61 86.59 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 122.786 0.435 . . . . 0.0 110.674 175.018 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -55.41 -58.11 9.1 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 124.267 0.98 . . . . 0.0 109.964 -175.076 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.507 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 8.1 ptm180 -64.65 -34.73 78.97 Favored 'General case' 0 CA--C 1.559 1.316 0 O-C-N 124.036 0.835 . . . . 0.0 111.71 177.123 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -63.73 -41.22 98.08 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 123.784 0.834 . . . . 0.0 112.489 -178.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.659 HD23 HD21 ' A' ' 66' ' ' LEU . 4.3 pp -89.8 -23.7 21.66 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 122.88 0.472 . . . . 0.0 110.061 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 67.1 m-70 . . . . . 0 N--CA 1.484 1.252 0 C-N-CA 123.328 0.651 . . . . 0.0 109.99 167.829 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.422 ' HB2' ' NE2' ' A' ' 63' ' ' GLN . 18.2 mt . . . . . 0 C--O 1.241 0.628 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -64.08 129.84 38.26 Favored Glycine 0 C--N 1.347 1.161 0 CA-C-O 119.244 -0.753 . . . . 0.0 111.483 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -63.84 -40.82 97.49 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.853 0.861 . . . . 0.0 112.235 -175.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 62.3 t -57.53 -39.23 68.07 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 C-N-CA 123.688 0.795 . . . . 0.0 109.518 173.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.536 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -63.87 -57.36 14.37 Favored Glycine 0 C--N 1.344 1.021 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.427 177.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.422 ' NE2' ' HB2' ' A' ' 58' ' ' LEU . 98.2 mt-30 -58.48 -42.86 88.51 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 124.966 1.306 . . . . 0.0 112.109 -175.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -70.19 -50.9 35.47 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.24 -173.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -62.78 -37.58 87.25 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.421 178.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.659 HD21 HD23 ' A' ' 27' ' ' LEU . 10.4 tp -58.27 -49.53 76.79 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.951 1.301 . . . . 0.0 109.963 178.368 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -66.74 -33.83 76.5 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.925 -176.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.34 -35.02 75.49 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.522 0.729 . . . . 0.0 110.571 175.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.449 HG21 ' HB2' ' A' ' 20' ' ' GLN . 97.3 mt -68.36 -54.21 23.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 123.731 0.813 . . . . 0.0 110.314 176.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -59.53 -32.14 70.04 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 124.918 1.287 . . . . 0.0 112.11 178.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.467 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -65.14 -46.61 80.24 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.303 0.641 . . . . 0.0 109.647 174.142 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.463 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -69.01 -36.18 77.5 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.702 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.538 HD22 HD13 ' A' ' 76' ' ' ILE . 73.8 mt -71.2 -34.06 70.52 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 124.165 0.986 . . . . 0.0 110.163 177.605 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.85 -36.77 85.01 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.131 173.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.467 ' HG2' ' O ' ' A' ' 71' ' ' ALA . 4.9 mmp_? -67.5 -35.96 80.14 Favored 'General case' 0 C--O 1.216 -0.707 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.839 175.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.538 HD13 HD22 ' A' ' 73' ' ' LEU . 64.7 mt -68.47 -43.34 83.97 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 CA-C-O 121.031 0.443 . . . . 0.0 110.385 179.004 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.7 -28.71 68.65 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.22 177.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.5 t -87.54 -15.9 36.17 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.786 0.834 . . . . 0.0 111.321 175.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 82.22 5.64 89.46 Favored Glycine 0 C--N 1.35 1.333 0 C-N-CA 123.187 0.422 . . . . 0.0 113.992 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.44 HG23 ' HD3' ' A' ' 75' ' ' ARG . 13.3 t -109.89 30.07 7.04 Favored 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 124.369 1.067 . . . . 0.0 110.538 -177.053 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.455 ' HE1' ' HB3' ' A' ' 72' ' ' ALA . 79.7 t80 -63.99 147.68 51.46 Favored 'General case' 0 N--CA 1.479 0.981 0 O-C-N 121.958 -0.464 . . . . 0.0 111.38 171.054 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 71.07 42.57 58.71 Favored Glycine 0 C--N 1.347 1.184 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.263 -175.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 98.0 m -129.61 122.28 28.77 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.34 1.056 . . . . 0.0 110.152 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . 0.452 ' HB2' ' HB3' ' A' ' 105' ' ' CYS . 47.3 t -76.49 100.12 5.15 Favored 'General case' 0 C--N 1.351 0.649 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 170.513 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 35.4 m -60.38 -29.06 43.51 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 O-C-N 124.318 1.011 . . . . 0.0 111.628 177.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.497 ' HD3' ' SG ' ' A' ' 108' ' ' CYS . 47.6 tttm -77.23 -6.28 52.48 Favored 'General case' 0 CA--C 1.56 1.351 0 C-N-CA 124.296 1.038 . . . . 0.0 111.665 -177.392 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 63.1 m -124.26 -33.96 2.99 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.981 0.913 . . . . 0.0 112.37 177.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 87.31 6.5 78.0 Favored Glycine 0 CA--C 1.537 1.415 0 N-CA-C 111.874 -0.49 . . . . 0.0 111.874 -160.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -96.34 -172.21 2.47 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.379 1.071 . . . . 0.0 111.233 -174.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 26.6 mmt85 -91.45 163.05 14.31 Favored 'General case' 0 C--O 1.244 0.791 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.467 169.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 20.1 mm -92.45 142.95 12.36 Favored 'Isoleucine or valine' 0 C--O 1.244 0.767 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 163.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 44.2 m -68.29 144.16 54.95 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 175.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -61.02 -36.45 79.55 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 122.625 0.37 . . . . 0.0 110.169 174.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -59.15 -40.88 86.92 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.304 1.042 . . . . 0.0 110.332 175.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -71.37 -38.16 71.57 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.559 177.056 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 73.2 mt -70.44 -35.42 73.36 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.613 0.765 . . . . 0.0 112.031 -177.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -79.24 -27.45 42.41 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -78.97 -27.88 43.54 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.004 0.922 . . . . 0.0 111.231 174.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.9 p -170.86 99.3 0.42 Allowed Pre-proline 0 CA--C 1.561 1.367 0 C-N-CA 124.937 1.295 . . . . 0.0 109.212 -178.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -75.55 -12.59 20.45 Favored 'Trans proline' 0 C--N 1.375 1.924 0 C-N-CA 122.366 2.044 . . . . 0.0 112.675 176.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 12.6 p90 -101.86 57.89 0.83 Allowed 'General case' 0 C--O 1.24 0.587 0 C-N-CA 124.215 1.006 . . . . 0.0 109.599 -179.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 11.9 t -131.88 117.26 16.09 Favored Pre-proline 0 CA--C 1.552 1.057 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.876 174.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -77.4 -4.77 15.05 Favored 'Trans proline' 0 C--N 1.375 1.923 0 C-N-CA 122.65 2.233 . . . . 0.0 112.134 171.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.42 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 16.2 m-85 -116.02 138.5 51.16 Favored 'General case' 0 C--N 1.353 0.753 0 C-N-CA 123.932 0.893 . . . . 0.0 110.369 -173.688 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.503 ' SG ' ' HB2' ' A' ' 107' ' ' GLU . 22.0 p -72.64 168.97 17.57 Favored 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 174.157 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -52.94 -37.75 61.27 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.802 0.841 . . . . 0.0 111.861 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.503 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 24.8 mt-10 -54.82 -53.47 54.77 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 124.211 1.004 . . . . 0.0 110.63 176.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.497 ' SG ' ' HD3' ' A' ' 86' ' ' LYS . 87.8 m -71.39 -38.59 71.48 Favored 'General case' 0 C--O 1.214 -0.775 0 CA-C-N 114.563 -1.199 . . . . 0.0 111.28 -176.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.95 -21.35 66.82 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.35 0.66 . . . . 0.0 111.216 176.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -85.07 -31.41 23.4 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.493 0.717 . . . . 0.0 111.291 172.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.98 0 C-N-CA 123.517 0.727 . . . . 0.0 111.28 -176.278 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.433 ' HB3' ' HG ' ' A' ' 11' ' ' SER . 65.3 t30 . . . . . 0 CA--C 1.545 0.78 0 CA-C-O 120.795 0.331 . . . . 0.0 111.555 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 39.8 t -61.32 -26.94 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.407 178.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -62.63 -40.54 97.3 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 124.305 1.042 . . . . 0.0 110.691 175.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.433 ' HG ' ' HB3' ' A' ' 8' ' ' ASN . 39.5 m -59.27 -44.18 92.46 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 121.052 0.453 . . . . 0.0 110.406 175.575 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -71.38 -32.5 68.54 Favored 'General case' 0 C--N 1.347 0.494 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.738 -179.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -62.49 -57.0 12.76 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.182 0.993 . . . . 0.0 109.292 -179.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 18.2 ptmt -66.76 -39.28 87.82 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 123.899 0.75 . . . . 0.0 112.404 -174.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 14.0 tt -63.37 -34.37 66.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 -179.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.523 ' HB3' HG23 ' A' ' 69' ' ' ILE . 80.4 mt -70.61 -33.67 71.29 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 122.927 0.491 . . . . 0.0 111.843 175.577 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.02 -46.24 85.35 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 122.964 0.505 . . . . 0.0 109.733 176.383 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -60.95 -49.94 75.43 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.775 0.83 . . . . 0.0 111.062 176.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.457 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 3.5 mpt_? -66.0 -37.3 85.57 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 115.168 -0.923 . . . . 0.0 111.778 -174.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.571 ' HB3' HG22 ' A' ' 69' ' ' ILE . 2.5 pt20 -70.72 -40.64 72.7 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 117.996 0.362 . . . . 0.0 110.389 -177.667 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 91.5 mtt-85 -79.39 -30.31 42.42 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 112.427 0.528 . . . . 0.0 112.427 -175.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -68.4 -31.06 70.15 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 172.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.495 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 97.7 mt -66.89 -51.34 56.58 Favored 'General case' 0 C--N 1.352 0.709 0 CA-C-O 119.113 -0.47 . . . . 0.0 110.232 170.326 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -49.83 -51.67 38.18 Favored 'General case' 0 N--CA 1.483 1.209 0 O-C-N 124.303 1.002 . . . . 0.0 111.923 -177.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.3 ptp85 -64.63 -38.66 91.77 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 123.306 0.379 . . . . 0.0 111.248 177.131 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -65.16 -33.53 76.24 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.581 0.752 . . . . 0.0 112.322 -177.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 4.1 pp -103.39 -17.03 15.43 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -175.554 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 71.4 m-70 . . . . . 0 N--CA 1.486 1.33 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 167.353 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.43 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 59.3 mt . . . . . 0 CA--C 1.558 1.267 0 N-CA-C 114.423 1.268 . . . . 0.0 114.423 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 159.41 101.69 0.17 Allowed Glycine 0 C--N 1.342 0.91 0 N-CA-C 110.149 -1.18 . . . . 0.0 110.149 -172.029 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -48.16 -53.33 17.15 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 124.552 1.141 . . . . 0.0 113.363 -168.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.466 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 95.1 t -57.59 -44.1 84.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 O-C-N 124.061 0.851 . . . . 0.0 110.425 -179.353 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -67.97 -33.36 79.14 Favored Glycine 0 C--N 1.347 1.179 0 O-C-N 123.98 0.8 . . . . 0.0 113.394 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -72.08 -43.67 64.47 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.521 0.728 . . . . 0.0 110.62 -179.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -70.22 -35.73 74.06 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.867 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' A' ' 61' ' ' VAL . 2.1 tp10 -66.39 -47.56 72.92 Favored 'General case' 0 C--N 1.349 0.554 0 CA-C-N 114.866 -1.061 . . . . 0.0 109.145 179.362 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 10.5 mt -51.33 -46.82 62.77 Favored 'General case' 0 N--CA 1.482 1.134 0 O-C-N 124.544 1.153 . . . . 0.0 110.999 173.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -64.01 -36.77 85.08 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.644 -176.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -74.76 -33.71 62.36 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.843 0.857 . . . . 0.0 111.469 177.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.571 HG22 ' HB3' ' A' ' 20' ' ' GLN . 69.9 mt -69.16 -55.85 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.782 0.833 . . . . 0.0 110.078 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -66.59 -21.91 66.13 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.567 1.147 . . . . 0.0 112.221 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.82 -49.81 71.4 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 121.275 0.559 . . . . 0.0 109.818 170.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.464 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -66.59 -41.51 88.37 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.244 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.415 HD22 HD12 ' A' ' 76' ' ' ILE . 79.6 mt -63.36 -41.26 98.82 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 124.386 1.074 . . . . 0.0 111.707 178.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.18 -40.17 84.81 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.762 0.825 . . . . 0.0 110.347 174.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 79.5 mtt85 -76.07 -23.11 55.01 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 115.087 -0.96 . . . . 0.0 112.731 -179.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.464 HG13 ' O ' ' A' ' 72' ' ' ALA . 85.3 mt -71.68 -44.34 69.45 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 173.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.42 -33.13 75.02 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.753 176.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 26.0 t -83.17 -19.35 36.75 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.67 0.788 . . . . 0.0 111.279 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 84.83 10.26 79.34 Favored Glycine 0 C--N 1.349 1.281 0 C-N-CA 122.924 0.297 . . . . 0.0 113.747 179.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.7 t -113.84 30.81 6.98 Favored 'General case' 0 CA--C 1.558 1.269 0 C-N-CA 123.92 0.888 . . . . 0.0 110.441 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -67.37 147.29 53.12 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 122.014 -0.429 . . . . 0.0 110.41 171.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.476 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 74.61 44.61 25.77 Favored Glycine 0 C--N 1.345 1.068 0 O-C-N 123.551 0.532 . . . . 0.0 111.823 -177.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 85.5 m -123.13 123.01 39.86 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.7 0.8 . . . . 0.0 110.366 179.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . 0.705 ' SG ' ' SG ' ' A' ' 87' ' ' CYS . 22.4 t -70.34 89.51 0.67 Allowed 'General case' 0 C--N 1.353 0.735 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 170.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 15.2 m -63.56 -30.27 49.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.832 0.853 . . . . 0.0 112.3 -169.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 57.1 tttm -69.23 -20.2 63.95 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.203 1.001 . . . . 0.0 111.128 179.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.705 ' SG ' ' SG ' ' A' ' 84' ' ' CYS . 7.0 m -119.49 -16.47 8.9 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.089 0.955 . . . . 0.0 111.386 -173.603 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 65.54 21.6 68.97 Favored Glycine 0 CA--C 1.539 1.562 0 C-N-CA 122.937 0.303 . . . . 0.0 112.956 -168.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -104.35 -170.2 1.73 Allowed 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.582 1.153 . . . . 0.0 110.987 -174.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.476 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 13.2 tpp180 -91.7 154.88 18.69 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.347 1.059 . . . . 0.0 110.494 178.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 31.8 mm -98.05 149.34 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 168.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.7 m -73.97 145.43 44.65 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.833 0.853 . . . . 0.0 109.526 175.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -62.63 -30.84 71.66 Favored 'General case' 0 N--CA 1.482 1.125 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 174.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.524 ' HA ' ' HE2' ' A' ' 97' ' ' LYS . 17.7 m-20 -62.36 -41.75 98.85 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.297 1.039 . . . . 0.0 111.295 175.536 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.409 ' HG3' HG23 ' A' ' 102' ' ' THR . 21.9 tpt180 -68.71 -40.55 79.91 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.1 176.766 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 94.4 mt -71.44 -32.24 68.11 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.152 0.581 . . . . 0.0 112.41 -177.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.665 ' HZ2' ' HB3' ' A' ' 97' ' ' LYS . 0.2 OUTLIER -78.13 -32.2 50.29 Favored 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -179.502 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.37 -41.33 56.63 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.003 0.921 . . . . 0.0 110.737 176.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.4 p -153.45 98.48 2.7 Favored Pre-proline 0 CA--C 1.556 1.175 0 C-N-CA 124.906 1.282 . . . . 0.0 108.803 -176.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_exo -68.73 -24.93 34.26 Favored 'Trans proline' 0 C--N 1.371 1.756 0 C-N-CA 122.584 2.189 . . . . 0.0 112.28 173.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 9.1 p90 -89.53 58.63 4.43 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.652 1.181 . . . . 0.0 109.988 -178.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' THR . . . . . 0.409 HG23 ' HG3' ' A' ' 95' ' ' ARG . 10.9 t -123.83 104.15 33.44 Favored Pre-proline 0 CA--C 1.559 1.294 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.684 -175.143 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -67.35 -36.63 20.09 Favored 'Trans proline' 0 C--N 1.378 2.126 0 C-N-CA 122.474 2.116 . . . . 0.0 111.839 174.191 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -99.69 174.73 6.09 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -178.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.695 ' SG ' ' SG ' ' A' ' 108' ' ' CYS . 24.9 p -98.38 179.09 4.83 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.343 0.657 . . . . 0.0 109.301 176.243 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -54.52 -56.88 14.34 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.739 0.816 . . . . 0.0 111.768 -179.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -69.32 -39.67 78.07 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.933 -176.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.695 ' SG ' ' SG ' ' A' ' 105' ' ' CYS . 80.6 m -78.66 -21.8 47.76 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -176.075 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -76.21 -33.12 59.26 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 171.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.87 -23.12 59.55 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.648 172.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.861 0 C-N-CA 124.28 1.032 . . . . 0.0 112.048 -176.761 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 8.5 m120 . . . . . 0 N--CA 1.473 0.715 0 CA-C-O 121.235 0.541 . . . . 0.0 111.845 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 21.9 t -70.7 -29.1 36.58 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 CA-C-N 115.344 -0.844 . . . . 0.0 109.791 176.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -68.77 -38.07 79.8 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.668 0.787 . . . . 0.0 111.183 178.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 27.8 m -63.45 -37.99 89.43 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.815 174.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -70.8 -34.22 71.52 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.861 175.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.474 ' HG2' HG22 ' A' ' 76' ' ' ILE . 4.7 mm-40 -55.42 -59.23 5.1 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 124.107 0.963 . . . . 0.0 109.963 178.749 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.2 ptmt -66.82 -45.64 77.67 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.858 -174.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.496 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 12.3 tt -64.3 -36.04 75.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 CA-C-N 117.861 0.301 . . . . 0.0 110.624 -174.354 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.57 ' HB3' HG21 ' A' ' 69' ' ' ILE . 63.1 mt -66.67 -38.08 86.08 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.227 0.611 . . . . 0.0 110.82 176.597 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.432 ' HA ' ' HG2' ' A' ' 20' ' ' GLN . 96.2 mtt-85 -72.18 -26.08 61.93 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 123.513 0.508 . . . . 0.0 111.57 178.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 53.5 m-20 -74.2 -40.06 62.73 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 122.872 0.469 . . . . 0.0 110.305 173.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.496 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -67.22 -40.13 86.35 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.416 177.183 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.579 ' HB3' HG23 ' A' ' 69' ' ' ILE . 1.3 pt20 -71.37 -31.07 66.89 Favored 'General case' 0 C--O 1.204 -1.303 0 CA-C-O 118.906 -0.569 . . . . 0.0 109.691 178.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -56.2 -54.58 43.54 Favored 'General case' 0 N--CA 1.496 1.862 0 CA-C-N 118.618 0.645 . . . . 0.0 110.548 174.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -67.9 -35.22 78.11 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.857 -176.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.53 ' HA ' ' HG2' ' A' ' 26' ' ' ARG . 97.8 mt -69.11 -50.62 46.44 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 122.792 0.437 . . . . 0.0 111.396 176.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -51.24 -46.0 62.18 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 124.513 1.125 . . . . 0.0 111.026 -178.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.1 ptm180 -75.17 -32.61 61.32 Favored 'General case' 0 CA--C 1.549 0.923 0 O-C-N 123.428 0.455 . . . . 0.0 111.779 -179.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.53 ' HG2' ' HA ' ' A' ' 23' ' ' LEU . 6.3 ptm180 -74.01 -27.27 60.88 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-N 118.075 0.398 . . . . 0.0 111.417 -177.614 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.0 pp -89.56 -31.99 17.35 Favored 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 110.04 -0.355 . . . . 0.0 110.04 176.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 55.4 m-70 . . . . . 0 N--CA 1.485 1.28 0 C-N-CA 123.146 0.578 . . . . 0.0 110.276 169.065 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 35.9 mt . . . . . 0 C--O 1.241 0.652 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -65.14 142.48 44.77 Favored Glycine 0 C--N 1.347 1.185 0 CA-C-O 119.524 -0.598 . . . . 0.0 112.309 178.267 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -58.34 -50.78 72.4 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.311 1.044 . . . . 0.0 111.286 -179.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 11.2 p -61.89 -33.66 59.06 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.261 177.042 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -67.23 -51.84 35.64 Favored Glycine 0 C--N 1.347 1.16 0 O-C-N 123.905 0.753 . . . . 0.0 112.443 -178.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -62.33 -43.87 97.82 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.06 0.944 . . . . 0.0 111.162 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -65.27 -48.04 74.6 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.973 -177.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -77.35 -27.38 52.69 Favored 'General case' 0 C--O 1.216 -0.669 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.83 -175.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.3 mp -59.72 -47.19 86.62 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-O 121.544 0.688 . . . . 0.0 109.286 169.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 40.0 ttt180 -60.57 -37.56 81.7 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 114.33 -1.304 . . . . 0.0 110.318 -178.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.33 -39.72 59.14 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.191 0.997 . . . . 0.0 111.741 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.579 HG23 ' HB3' ' A' ' 20' ' ' GLN . 67.8 mt -74.68 -57.87 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 123.713 0.805 . . . . 0.0 110.274 -177.288 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -56.2 -33.54 65.42 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.218 1.007 . . . . 0.0 111.79 177.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.44 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -63.53 -51.33 65.92 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 110.269 -0.271 . . . . 0.0 110.269 171.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.477 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -58.57 -44.78 89.87 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.942 0.897 . . . . 0.0 111.588 -177.788 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.415 HD22 ' HB2' ' A' ' 16' ' ' LEU . 95.8 mt -64.68 -38.43 90.96 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 124.745 1.218 . . . . 0.0 111.463 179.13 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.75 -33.38 74.74 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.728 176.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.44 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 79.8 mtt-85 -74.84 -25.49 59.03 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.511 0.724 . . . . 0.0 111.051 177.181 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.477 HG13 ' O ' ' A' ' 72' ' ' ALA . 82.7 mt -70.91 -46.43 68.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 172.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.36 -25.79 68.19 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.861 0.864 . . . . 0.0 111.347 176.359 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.9 t -83.9 -29.57 27.07 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.941 0.896 . . . . 0.0 111.133 174.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 84.94 14.8 68.82 Favored Glycine 0 C--N 1.349 1.297 0 C-N-CA 123.034 0.35 . . . . 0.0 113.421 -176.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 15.3 t -106.13 7.57 31.74 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 123.809 0.844 . . . . 0.0 110.819 178.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -67.55 145.47 54.87 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 171.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.402 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 83.68 12.91 76.8 Favored Glycine 0 C--N 1.344 0.972 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.864 -171.19 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 43.4 m -130.39 119.18 22.34 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.217 1.007 . . . . 0.0 109.792 175.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 41.9 t -64.28 100.56 0.35 Allowed 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.9 0.88 . . . . 0.0 109.314 171.361 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.439 HG12 ' NH1' ' A' ' 75' ' ' ARG . 24.9 m -67.4 -23.61 30.34 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.918 0 C-N-CA 123.841 0.856 . . . . 0.0 111.782 -179.616 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 42.4 tttm -70.48 -17.56 62.97 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.598 0.759 . . . . 0.0 110.86 174.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 54.3 m -112.14 -29.39 7.6 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 124.295 1.038 . . . . 0.0 111.811 177.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 69.4 22.24 76.31 Favored Glycine 0 CA--C 1.539 1.58 0 CA-C-N 116.176 -0.465 . . . . 0.0 112.406 -162.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -126.09 174.38 8.52 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 124.674 1.19 . . . . 0.0 109.209 -174.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.402 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 13.3 tpp180 -67.04 158.23 31.53 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 124.708 1.203 . . . . 0.0 112.629 -173.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 13.1 mm -100.19 146.37 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 N-CA-C 107.786 -1.191 . . . . 0.0 107.786 164.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.7 m -72.36 140.97 48.75 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 173.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -63.72 -29.25 70.49 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 175.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -55.66 -49.68 72.25 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.658 1.183 . . . . 0.0 110.117 173.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.446 ' HG3' HG23 ' A' ' 102' ' ' THR . 26.2 tpt180 -62.19 -46.41 89.04 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 113.907 -1.497 . . . . 0.0 110.804 178.407 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 97.1 mt -66.22 -39.74 89.81 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.538 0.735 . . . . 0.0 112.087 -175.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.483 ' HZ1' ' HB3' ' A' ' 97' ' ' LYS . 0.6 OUTLIER -74.87 -32.03 61.76 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 122.353 0.261 . . . . 0.0 110.435 -176.221 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -79.3 -43.16 24.19 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.645 0.778 . . . . 0.0 111.192 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.1 p -148.2 95.32 4.12 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 124.724 1.21 . . . . 0.0 108.473 -177.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -79.64 -6.5 14.44 Favored 'Trans proline' 0 C--N 1.371 1.714 0 C-N-CA 122.382 2.055 . . . . 0.0 113.579 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . 0.401 ' HB3' HD21 ' A' ' 16' ' ' LEU . 20.0 p90 -95.54 47.83 1.13 Allowed 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 121.732 0.777 . . . . 0.0 110.282 177.491 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' THR . . . . . 0.446 HG23 ' HG3' ' A' ' 95' ' ' ARG . 13.3 t -125.75 111.11 25.13 Favored Pre-proline 0 CA--C 1.559 1.302 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.241 178.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo -74.91 -13.48 21.63 Favored 'Trans proline' 0 C--N 1.369 1.651 0 C-N-CA 122.552 2.168 . . . . 0.0 111.834 169.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -104.4 156.76 17.66 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.425 1.09 . . . . 0.0 110.331 -176.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.401 ' SG ' ' HB2' ' A' ' 107' ' ' GLU . 30.6 p -83.8 171.1 13.45 Favored 'General case' 0 N--CA 1.481 1.113 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 172.671 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -59.8 -35.55 74.91 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.46 0.704 . . . . 0.0 111.057 -176.017 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.401 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 26.3 mt-10 -58.03 -54.41 47.29 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 114.902 -1.045 . . . . 0.0 110.738 173.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 79.9 m -64.91 -35.8 82.3 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 123.885 0.741 . . . . 0.0 111.485 -178.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -63.72 -45.28 90.65 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.889 0.875 . . . . 0.0 110.258 -179.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.67 -20.39 61.25 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.344 177.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.804 0 C-N-CA 124.006 0.922 . . . . 0.0 112.227 -179.634 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 13.2 m120 . . . . . 0 N--CA 1.476 0.857 0 CA-C-O 121.12 0.486 . . . . 0.0 111.408 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 59.3 t -62.85 -36.04 73.76 Favored 'Isoleucine or valine' 0 C--N 1.351 0.671 0 C-N-CA 123.629 0.772 . . . . 0.0 110.342 -178.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -60.77 -38.81 86.53 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.962 0.905 . . . . 0.0 111.948 -179.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 28.5 m -64.92 -44.34 89.83 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.505 0.722 . . . . 0.0 110.004 175.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -69.47 -32.55 71.53 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.143 179.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -64.55 -54.92 24.54 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.438 1.095 . . . . 0.0 109.632 -176.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.583 ' HZ1' ' HB2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -66.01 -38.76 89.26 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.733 -176.679 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 12.6 tt -69.66 -31.36 48.43 Favored 'Isoleucine or valine' 0 C--N 1.362 1.113 0 N-CA-C 110.29 -0.263 . . . . 0.0 110.29 -179.176 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.547 ' HB3' HG23 ' A' ' 69' ' ' ILE . 55.3 mt -70.96 -38.51 72.79 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.273 0.629 . . . . 0.0 111.147 176.262 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.483 ' O ' ' HG3' ' A' ' 21' ' ' ARG . 1.3 mmp_? -59.63 -46.76 88.04 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 123.694 0.621 . . . . 0.0 110.049 176.009 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.504 ' HA ' ' HD2' ' A' ' 21' ' ' ARG . 3.8 m-20 -73.25 -32.9 64.98 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -69.04 -40.14 78.76 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 122.8 0.44 . . . . 0.0 110.639 179.411 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.579 ' HB3' HG22 ' A' ' 69' ' ' ILE . 3.5 pt20 -72.46 -31.38 65.38 Favored 'General case' 0 C--O 1.2 -1.54 0 CA-C-O 118.594 -0.717 . . . . 0.0 109.715 176.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.504 ' HD2' ' HA ' ' A' ' 18' ' ' ASP . 65.4 mtt-85 -58.49 -48.89 79.31 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-N 118.583 0.628 . . . . 0.0 111.276 178.551 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -70.58 -32.88 70.43 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.341 -178.031 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.487 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 96.6 mt -76.93 -34.02 57.68 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 122.724 0.41 . . . . 0.0 111.943 176.328 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -67.01 -51.13 58.74 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.954 0.901 . . . . 0.0 108.815 179.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.6 ptp180 -62.78 -32.13 73.24 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.538 0.735 . . . . 0.0 110.302 -179.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -60.79 -46.64 89.72 Favored 'General case' 0 C--N 1.363 1.174 0 C-N-CA 123.656 0.782 . . . . 0.0 111.782 176.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.571 ' HB2' ' HA ' ' A' ' 58' ' ' LEU . 2.7 pp -96.85 -0.37 47.95 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -177.741 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 . . . . . 0 N--CA 1.486 1.353 0 C-N-CA 123.895 0.878 . . . . 0.0 109.993 172.479 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.571 ' HA ' ' HB2' ' A' ' 27' ' ' LEU . 6.4 mp . . . . . 0 CA--C 1.544 0.75 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -76.99 143.47 28.8 Favored Glycine 0 N--CA 1.471 0.988 0 CA-C-O 118.502 -1.165 . . . . 0.0 110.992 179.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -51.81 -52.56 48.23 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 124.348 1.059 . . . . 0.0 112.546 -171.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.443 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 7.5 p -53.6 -39.12 36.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 O-C-N 123.841 0.713 . . . . 0.0 111.761 177.124 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.404 ' O ' HD12 ' A' ' 66' ' ' LEU . . . -68.59 -43.28 77.41 Favored Glycine 0 C--N 1.345 1.069 0 O-C-N 123.616 0.573 . . . . 0.0 112.152 177.285 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -67.26 -41.57 85.32 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.637 0.775 . . . . 0.0 110.997 -175.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -74.74 -28.23 60.69 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 124.094 0.871 . . . . 0.0 111.239 179.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.443 ' HB2' ' O ' ' A' ' 61' ' ' VAL . 0.5 OUTLIER -71.73 -44.86 63.4 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 177.63 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.404 HD12 ' O ' ' A' ' 62' ' ' GLY . 5.8 mp -57.0 -47.83 79.9 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.759 1.224 . . . . 0.0 110.171 170.416 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -61.47 -37.21 82.78 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.132 0.973 . . . . 0.0 110.834 -176.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.67 -40.97 65.88 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.064 0.946 . . . . 0.0 111.021 177.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.579 HG22 ' HB3' ' A' ' 20' ' ' GLN . 83.3 mt -66.29 -53.33 37.65 Favored 'Isoleucine or valine' 0 C--N 1.356 0.857 0 C-N-CA 123.493 0.717 . . . . 0.0 110.804 -179.205 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -65.35 -27.28 68.47 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.943 0.897 . . . . 0.0 111.925 178.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.3 -37.02 77.59 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 122.686 0.394 . . . . 0.0 110.326 172.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.513 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -69.62 -41.71 75.32 Favored 'General case' 0 C--N 1.348 0.507 0 C-N-CA 123.368 0.667 . . . . 0.0 110.644 176.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.507 HD22 HD12 ' A' ' 76' ' ' ILE . 86.5 mt -68.02 -32.55 73.0 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.181 0.993 . . . . 0.0 110.923 179.137 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.5 -38.93 85.07 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.819 0.848 . . . . 0.0 110.383 173.047 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 87.1 mtm180 -67.69 -30.53 70.07 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.979 174.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.513 HG13 ' O ' ' A' ' 72' ' ' ALA . 74.2 mt -70.84 -40.85 77.1 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 175.571 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.5 -32.46 72.49 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.896 0.878 . . . . 0.0 111.526 177.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.48 ' HB3' HG22 ' A' ' 80' ' ' THR . 34.2 t -88.08 -22.54 24.11 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.465 0.706 . . . . 0.0 111.154 176.453 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 85.31 9.77 78.9 Favored Glycine 0 C--N 1.346 1.116 0 CA-C-N 116.594 -0.275 . . . . 0.0 113.058 -175.552 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.48 HG22 ' HB3' ' A' ' 78' ' ' SER . 15.0 t -102.97 26.4 8.21 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.221 1.008 . . . . 0.0 109.612 179.302 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 90.9 t80 -63.93 147.74 51.23 Favored 'General case' 0 C--N 1.351 0.642 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 171.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 69.56 46.39 55.33 Favored Glycine 0 C--N 1.341 0.854 0 N-CA-C 110.737 -0.945 . . . . 0.0 110.737 -172.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 98.7 m -129.63 116.95 19.61 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.703 0.801 . . . . 0.0 110.167 174.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 42.9 t -68.52 100.26 1.08 Allowed 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 166.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 33.7 m -62.19 -27.4 42.48 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 123.995 0.918 . . . . 0.0 112.456 -176.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.503 ' HD2' ' HB3' ' A' ' 108' ' ' CYS . 24.5 ttmm -67.21 -33.69 75.9 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.496 0.718 . . . . 0.0 110.24 174.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 54.7 m -86.89 -29.18 22.34 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.632 0.773 . . . . 0.0 111.149 174.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 66.99 22.09 72.05 Favored Glycine 0 C--N 1.342 0.894 0 CA-C-N 115.79 -0.641 . . . . 0.0 112.392 -165.2 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -138.1 173.44 11.62 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.764 0.826 . . . . 0.0 110.684 -173.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 -64.89 151.47 45.54 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.943 1.297 . . . . 0.0 114.335 -170.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 13.7 mm -90.94 150.78 3.64 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.952 0 C-N-CA 125.537 1.535 . . . . 0.0 109.131 173.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 31.6 m -75.97 151.95 37.13 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 175.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -59.16 -41.62 88.79 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.202 0.601 . . . . 0.0 111.142 -179.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -61.7 -39.46 91.55 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.042 0.937 . . . . 0.0 111.217 -178.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.499 ' HE ' HG21 ' A' ' 102' ' ' THR . 29.7 tpt180 -64.74 -42.98 94.79 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.741 176.293 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 92.1 mt -67.98 -41.6 82.1 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.362 0.665 . . . . 0.0 112.209 -176.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -71.8 -28.3 63.51 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 122.587 0.355 . . . . 0.0 110.55 -178.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.22 -38.3 27.21 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.54 0.736 . . . . 0.0 110.884 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.4 p -160.76 95.55 1.45 Allowed Pre-proline 0 CA--C 1.559 1.291 0 C-N-CA 124.738 1.215 . . . . 0.0 109.501 -176.108 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . 0.511 ' HG2' HD21 ' A' ' 16' ' ' LEU . 69.2 Cg_endo -77.56 -23.28 9.97 Favored 'Trans proline' 0 C--N 1.375 1.972 0 C-N-CA 122.618 2.212 . . . . 0.0 113.539 -178.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 32.1 p90 -80.93 -9.3 59.85 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 -174.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' THR . . . . . 0.499 HG21 ' HE ' ' A' ' 95' ' ' ARG . 12.4 t -64.87 125.99 90.14 Favored Pre-proline 0 CA--C 1.565 1.527 0 CA-C-N 117.731 0.242 . . . . 0.0 111.187 -176.199 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -75.83 -12.93 19.89 Favored 'Trans proline' 0 C--N 1.375 1.931 0 C-N-CA 122.62 2.213 . . . . 0.0 112.627 174.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -121.68 157.11 31.6 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.608 0.763 . . . . 0.0 110.161 -176.268 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.48 ' SG ' ' OE1' ' A' ' 107' ' ' GLU . 29.3 p -86.02 165.21 16.86 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 175.607 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -46.39 -44.16 16.89 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 124.886 1.274 . . . . 0.0 114.35 -160.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.48 ' OE1' ' SG ' ' A' ' 105' ' ' CYS . 0.0 OUTLIER -84.04 -26.86 28.76 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 122.215 -0.303 . . . . 0.0 110.787 -176.286 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.503 ' HB3' ' HD2' ' A' ' 86' ' ' LYS . 95.7 m -69.86 -26.45 64.21 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.961 0.904 . . . . 0.0 110.473 174.499 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -75.45 -36.23 60.74 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.851 0.86 . . . . 0.0 110.048 172.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -78.13 -8.86 58.8 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.942 173.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.056 0 C-N-CA 123.647 0.779 . . . . 0.0 111.117 174.763 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 11.5 m120 . . . . . 0 N--CA 1.494 1.754 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.5 t -50.98 -46.83 30.64 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 C-N-CA 123.571 0.748 . . . . 0.0 112.088 175.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -65.56 -36.01 82.53 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.515 0.726 . . . . 0.0 111.681 -176.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.0 m -67.11 -37.97 84.82 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.256 176.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -70.23 -35.5 73.88 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.272 176.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.1 tm-20 -60.71 -57.63 11.87 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.984 0.913 . . . . 0.0 109.381 -176.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.434 ' HG3' ' N ' ' A' ' 15' ' ' ILE . 12.8 ptmt -63.82 -42.11 97.73 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.592 -176.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.434 ' N ' ' HG3' ' A' ' 14' ' ' LYS . 15.2 tt -68.78 -29.48 43.72 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 -175.061 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.528 ' HB3' HG22 ' A' ' 69' ' ' ILE . 70.7 mt -74.01 -35.48 64.39 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.241 0.616 . . . . 0.0 110.779 174.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.436 ' NH2' HD12 ' A' ' 73' ' ' LEU . 1.7 mmp_? -59.98 -49.28 78.29 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 172.356 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 49.2 m-20 -64.12 -41.64 97.15 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 124.006 0.922 . . . . 0.0 110.943 -177.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -66.87 -46.02 76.29 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.68 -178.626 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.541 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.8 pt20 -67.45 -29.25 68.67 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-O 118.871 -0.585 . . . . 0.0 110.099 -179.394 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.3 mmt180 -70.22 -46.86 63.64 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.708 0.803 . . . . 0.0 111.867 -179.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -68.43 -32.7 72.92 Favored 'General case' 0 N--CA 1.48 1.067 0 O-C-N 123.238 0.336 . . . . 0.0 110.542 178.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.4 HD13 ' HB3' ' A' ' 65' ' ' GLU . 97.1 mt -74.54 -33.29 62.7 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.021 174.401 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -58.89 -59.66 5.09 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 38.3 ptt180 -59.01 -37.57 77.21 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 123.719 0.637 . . . . 0.0 111.28 -178.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 75.5 ttt180 -57.42 -56.11 26.15 Favored 'General case' 0 C--N 1.356 0.874 0 C-N-CA 124.119 0.968 . . . . 0.0 112.046 178.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.419 ' O ' ' HA ' ' A' ' 58' ' ' LEU . 4.5 pp -87.85 -22.55 24.39 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -172.536 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 . . . . . 0 N--CA 1.481 1.116 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 175.752 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.419 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 68.5 mt . . . . . 0 CA--C 1.546 0.793 0 N-CA-C 110.413 -0.217 . . . . 0.0 110.413 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 127.0 114.51 1.88 Allowed Glycine 0 N--CA 1.472 1.035 0 N-CA-C 110.819 -0.913 . . . . 0.0 110.819 -176.392 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -49.93 -52.62 31.93 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.273 1.429 . . . . 0.0 113.37 -170.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 7.4 p -53.08 -42.56 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 123.234 0.614 . . . . 0.0 112.205 -178.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -74.74 -32.83 56.73 Favored Glycine 0 C--N 1.344 1.011 0 CA-C-N 115.538 -0.756 . . . . 0.0 112.113 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -68.34 -45.76 71.99 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.626 0.77 . . . . 0.0 111.43 -179.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -64.76 -36.75 85.32 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.542 0.737 . . . . 0.0 109.662 176.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.4 ' HB3' HD13 ' A' ' 23' ' ' LEU . 0.9 OUTLIER -64.31 -48.56 75.18 Favored 'General case' 0 C--N 1.354 0.789 0 O-C-N 124.122 0.889 . . . . 0.0 110.467 177.416 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.4 mp -57.38 -46.62 83.2 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.175 0.99 . . . . 0.0 110.635 177.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 77.2 ttt180 -62.24 -37.1 84.11 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.508 -178.1 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.432 ' HB1' ' O ' ' A' ' 101' ' ' TYR . . . -74.53 -39.33 62.43 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 123.995 0.918 . . . . 0.0 111.542 179.201 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.541 HG21 ' HB3' ' A' ' 20' ' ' GLN . 85.3 mt -73.06 -54.92 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 123.785 0.834 . . . . 0.0 110.39 -176.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -59.67 -30.18 68.58 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.05 0.94 . . . . 0.0 111.789 176.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.472 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -64.11 -52.68 57.99 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 123.429 0.456 . . . . 0.0 110.319 172.094 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.46 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -61.2 -40.41 93.84 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.929 0.892 . . . . 0.0 111.496 -178.138 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.5 HD22 HD13 ' A' ' 76' ' ' ILE . 66.1 mt -67.84 -37.1 81.46 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.711 1.205 . . . . 0.0 111.505 178.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.61 -33.04 75.01 Favored 'General case' 0 N--CA 1.478 0.951 0 O-C-N 123.615 0.572 . . . . 0.0 110.296 173.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.472 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 79.7 mtt-85 -79.99 -25.91 40.12 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.274 0.629 . . . . 0.0 111.466 178.288 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.5 HD13 HD22 ' A' ' 73' ' ' LEU . 98.1 mt -71.33 -49.9 44.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 175.708 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.19 -28.09 68.49 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.606 0.762 . . . . 0.0 111.106 178.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 30.5 t -75.56 -34.22 60.7 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.43 0.692 . . . . 0.0 110.627 172.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 90.78 7.94 65.88 Favored Glycine 0 CA--C 1.53 0.989 0 CA-C-N 115.759 -0.655 . . . . 0.0 113.158 -176.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 14.0 t -97.44 10.35 39.95 Favored 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 123.669 0.788 . . . . 0.0 110.481 178.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -64.93 136.55 56.95 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.082 0.553 . . . . 0.0 109.914 171.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.15 13.14 64.51 Favored Glycine 0 CA--C 1.527 0.803 0 O-C-N 123.619 0.575 . . . . 0.0 111.89 -169.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 89.4 m -125.68 119.67 28.63 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 123.741 0.816 . . . . 0.0 109.753 175.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . 0.418 ' HB2' HD12 ' A' ' 91' ' ' ILE . 49.6 t -77.06 91.89 3.7 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 124.072 0.949 . . . . 0.0 109.743 170.635 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 25.3 m -64.35 -20.02 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 124.016 0.927 . . . . 0.0 112.152 -178.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 49.8 tttm -66.41 -22.8 66.24 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.928 0.891 . . . . 0.0 111.874 -179.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.437 ' SG ' ' HB2' ' A' ' 89' ' ' LYS . 31.7 p -137.85 10.07 2.85 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 122.635 0.374 . . . . 0.0 111.488 177.014 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 63.85 20.21 64.07 Favored Glycine 0 C--N 1.358 1.76 0 N-CA-C 114.185 0.434 . . . . 0.0 114.185 179.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.437 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 31.6 mmmt -106.92 -173.77 2.37 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.094 0.958 . . . . 0.0 110.62 -176.487 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 13.1 mmm180 -83.54 163.84 20.18 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 124.454 1.102 . . . . 0.0 112.139 176.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.418 HD12 ' HB2' ' A' ' 84' ' ' CYS . 5.7 mm -101.21 143.43 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 N-CA-C 106.416 -1.698 . . . . 0.0 106.416 159.361 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.6 m -70.9 140.82 51.13 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 173.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -61.06 -35.86 78.08 Favored 'General case' 0 N--CA 1.483 1.185 0 CA-C-N 117.95 0.341 . . . . 0.0 110.124 174.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -58.29 -40.92 83.23 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.187 0.995 . . . . 0.0 110.34 175.337 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.524 ' HD2' ' HB2' ' A' ' 106' ' ' GLN . 0.2 OUTLIER -68.71 -40.19 80.08 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.699 176.947 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 94.6 mt -69.01 -34.81 75.87 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.844 0.858 . . . . 0.0 112.307 -176.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 15.5 ptpt -80.73 -27.08 36.99 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 122.627 0.371 . . . . 0.0 110.215 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -79.31 -29.36 42.34 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.643 0.777 . . . . 0.0 110.999 175.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.3 p -165.84 99.9 0.74 Allowed Pre-proline 0 CA--C 1.557 1.244 0 C-N-CA 124.828 1.251 . . . . 0.0 108.909 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . 0.436 ' HG2' HD21 ' A' ' 16' ' ' LEU . 79.2 Cg_endo -78.21 -12.93 15.65 Favored 'Trans proline' 0 C--N 1.373 1.845 0 C-N-CA 122.65 2.233 . . . . 0.0 113.681 179.113 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . 0.432 ' O ' ' HB1' ' A' ' 68' ' ' ALA . 24.0 p90 -94.66 22.02 6.73 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 122.601 0.361 . . . . 0.0 111.932 -179.211 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 14.1 t -97.51 112.48 61.35 Favored Pre-proline 0 CA--C 1.56 1.358 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 172.526 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -78.39 -4.44 14.22 Favored 'Trans proline' 0 C--N 1.376 1.977 0 C-N-CA 122.635 2.224 . . . . 0.0 112.009 171.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -114.75 146.15 41.29 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.957 0.903 . . . . 0.0 109.975 -176.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 26.0 p -75.67 160.72 29.77 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 175.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.524 ' HB2' ' HD2' ' A' ' 95' ' ' ARG . 52.0 tp60 -56.61 -29.95 62.73 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 118.387 0.539 . . . . 0.0 111.779 -175.312 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -61.57 -49.75 75.41 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 124.826 1.25 . . . . 0.0 109.844 177.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 98.3 m -70.3 -36.29 74.25 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.346 0.658 . . . . 0.0 111.662 177.047 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -61.38 -33.97 74.55 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.782 0.833 . . . . 0.0 110.968 179.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -82.6 -28.91 30.52 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.819 0.847 . . . . 0.0 111.152 175.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.265 0 C-N-CA 124.065 0.946 . . . . 0.0 112.61 -174.418 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 52.5 t30 . . . . . 0 N--CA 1.483 1.217 0 CA-C-O 121.369 0.604 . . . . 0.0 112.026 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.8 t -71.57 -26.43 26.24 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.034 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.199 -179.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -58.53 -42.21 87.26 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 123.207 0.603 . . . . 0.0 112.544 -174.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 33.2 m -59.73 -41.86 91.83 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 121.352 0.596 . . . . 0.0 110.833 178.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -71.34 -38.39 71.66 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-N 114.942 -1.026 . . . . 0.0 110.487 179.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.461 ' O ' ' HG3' ' A' ' 17' ' ' ARG . 3.0 tm-20 -57.9 -54.95 41.09 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.507 1.123 . . . . 0.0 110.127 -177.546 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.544 ' HB2' ' HZ2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -66.56 -41.59 88.4 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.171 -176.771 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 14.9 tt -68.22 -29.94 46.14 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 N-CA-C 110.329 -0.249 . . . . 0.0 110.329 -177.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.535 ' HB3' HG21 ' A' ' 69' ' ' ILE . 77.5 mt -73.35 -33.19 64.96 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.673 0.789 . . . . 0.0 111.168 176.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.461 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 25.7 mtm180 -64.51 -37.51 87.78 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 175.274 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -82.52 -24.68 33.98 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.002 0.521 . . . . 0.0 110.522 -178.536 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.402 ' HD2' ' HA ' ' A' ' 19' ' ' ARG . 18.4 tpt180 -73.45 -43.45 60.29 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.505 179.347 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.537 ' HB3' HG23 ' A' ' 69' ' ' ILE . 2.7 pt20 -73.45 -29.46 62.56 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 119.005 -0.521 . . . . 0.0 110.018 176.467 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 91.8 mtt180 -55.29 -58.29 8.32 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 172.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -63.78 -38.24 90.37 Favored 'General case' 0 C--N 1.352 0.686 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.098 -175.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.689 HD22 HH11 ' A' ' 26' ' ' ARG . 89.4 mt -65.34 -52.24 55.12 Favored 'General case' 0 C--O 1.216 -0.688 0 O-C-N 123.877 0.735 . . . . 0.0 110.956 177.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -48.0 -53.49 16.03 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 124.303 1.041 . . . . 0.0 111.25 -178.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -74.88 -26.19 59.49 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -178.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.689 HH11 HD22 ' A' ' 23' ' ' LEU . 39.5 ttm180 -66.58 -48.94 67.97 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.832 0.853 . . . . 0.0 111.124 175.607 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.506 HD22 HD23 ' A' ' 66' ' ' LEU . 4.1 pp -80.38 -24.69 39.59 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.31 0.644 . . . . 0.0 110.679 -178.192 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 52.6 m170 . . . . . 0 N--CA 1.483 1.179 0 C-N-CA 123.171 0.589 . . . . 0.0 111.21 171.927 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.467 HD12 HD12 ' A' ' 27' ' ' LEU . 31.8 mt . . . . . 0 N--CA 1.471 0.597 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -58.68 130.12 50.58 Favored Glycine 0 CA--C 1.534 1.242 0 CA-C-O 119.207 -0.774 . . . . 0.0 112.197 176.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -67.15 -42.21 84.75 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.304 0.642 . . . . 0.0 112.313 -171.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 7.3 p -59.9 -32.09 49.07 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 C-N-CA 122.926 0.491 . . . . 0.0 109.74 173.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.522 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -64.86 -56.69 15.01 Favored Glycine 0 C--O 1.214 -1.104 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.615 174.586 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.441 ' NE2' ' HB2' ' A' ' 58' ' ' LEU . 98.0 mt-30 -58.9 -43.77 91.07 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 125.173 1.389 . . . . 0.0 111.946 -176.631 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -67.28 -49.11 65.57 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.125 -175.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -70.02 -28.9 65.87 Favored 'General case' 0 C--O 1.217 -0.614 0 CA-C-N 114.649 -1.16 . . . . 0.0 110.24 179.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.522 ' HB2' ' O ' ' A' ' 62' ' ' GLY . 11.1 tp -64.24 -44.79 90.74 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.358 1.063 . . . . 0.0 109.551 178.874 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 65.2 ttt180 -74.95 -29.48 60.94 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 114.736 -1.12 . . . . 0.0 110.507 -179.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.57 -41.34 88.72 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.423 0.689 . . . . 0.0 110.247 174.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.537 HG23 ' HB3' ' A' ' 20' ' ' GLN . 95.5 mt -70.56 -37.76 71.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.887 0.875 . . . . 0.0 109.875 175.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -63.24 -36.43 83.62 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.272 0.629 . . . . 0.0 110.268 176.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -75.88 -34.08 59.98 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.906 0.882 . . . . 0.0 111.113 177.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.468 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -69.92 -53.88 15.88 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.441 0.696 . . . . 0.0 110.73 -179.408 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.53 HD22 HD13 ' A' ' 76' ' ' ILE . 95.5 mt -61.78 -31.94 72.19 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.455 1.102 . . . . 0.0 111.249 176.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.53 -49.69 76.54 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 123.615 0.572 . . . . 0.0 110.175 172.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.426 ' HE ' ' HA ' ' A' ' 72' ' ' ALA . 86.8 mtm180 -63.56 -30.9 71.95 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 124.043 0.839 . . . . 0.0 111.844 178.427 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.53 HD13 HD22 ' A' ' 73' ' ' LEU . 66.4 mt -69.24 -43.42 81.37 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 177.019 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.62 -25.23 64.74 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.941 176.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 69.8 m -91.61 -7.55 49.78 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.413 1.085 . . . . 0.0 112.344 178.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 69.33 23.46 76.36 Favored Glycine 0 C--N 1.35 1.325 0 N-CA-C 113.77 0.268 . . . . 0.0 113.77 178.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 9.9 t -129.85 29.34 5.0 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 124.589 1.156 . . . . 0.0 110.449 -179.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -63.97 148.66 49.07 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 121.938 -0.476 . . . . 0.0 110.271 171.573 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.454 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 70.09 37.72 73.07 Favored Glycine 0 C--N 1.342 0.866 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.611 -175.267 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 90.8 m -129.45 124.06 33.13 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.588 0.755 . . . . 0.0 109.448 175.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . 0.425 ' HB3' ' HB2' ' A' ' 87' ' ' CYS . 37.5 t -67.85 108.37 2.97 Favored 'General case' 0 C--N 1.35 0.622 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 169.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 29.2 m -62.34 -28.47 44.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 O-C-N 124.134 0.896 . . . . 0.0 111.167 176.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 38.3 tttm -81.11 -8.04 59.68 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.518 1.127 . . . . 0.0 111.673 -177.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.506 ' HB3' ' HG2' ' A' ' 89' ' ' LYS . 60.8 m -122.07 -24.1 5.22 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.895 0.878 . . . . 0.0 111.696 176.678 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 62.77 46.58 93.35 Favored Glycine 0 CA--C 1.537 1.425 0 O-C-N 123.508 0.505 . . . . 0.0 113.178 -168.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.506 ' HG2' ' HB3' ' A' ' 87' ' ' CYS . 0.0 OUTLIER -159.88 171.17 19.91 Favored 'General case' 0 N--CA 1.498 1.945 0 N-CA-C 112.616 0.598 . . . . 0.0 112.616 -179.103 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.454 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 13.9 tpp180 -64.4 144.11 57.41 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 125.377 1.471 . . . . 0.0 113.192 -172.462 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 26.1 mm -91.73 149.7 4.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 125.179 1.392 . . . . 0.0 108.847 172.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 24.8 m -67.58 140.59 56.94 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 174.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -59.21 -36.54 75.59 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 122.869 0.468 . . . . 0.0 111.209 -178.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -63.96 -36.05 82.68 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.658 0.783 . . . . 0.0 111.267 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.515 ' HD2' ' HB2' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -65.57 -40.71 93.09 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.221 175.45 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 95.2 mt -75.07 -31.74 61.31 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -176.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.2 ptpt -76.03 -28.17 57.61 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 109.827 -0.435 . . . . 0.0 109.827 178.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -83.48 -35.24 25.05 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.671 0.788 . . . . 0.0 111.316 176.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.4 p -158.53 91.9 2.06 Favored Pre-proline 0 CA--C 1.557 1.237 0 C-N-CA 124.536 1.134 . . . . 0.0 109.055 -177.162 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . 0.522 ' HG2' HD23 ' A' ' 16' ' ' LEU . 58.8 Cg_endo -74.06 -28.27 11.12 Favored 'Trans proline' 0 C--N 1.377 2.069 0 C-N-CA 122.639 2.226 . . . . 0.0 113.324 -178.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . 0.451 ' HA ' ' HB3' ' A' ' 72' ' ' ALA . 29.6 p90 -77.96 -2.55 37.51 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -173.407 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.1 t -65.62 116.77 34.82 Favored Pre-proline 0 CA--C 1.563 1.457 0 CA-C-N 117.862 0.301 . . . . 0.0 110.72 -179.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -73.45 -16.51 24.38 Favored 'Trans proline' 0 C--N 1.381 2.259 0 C-N-CA 122.489 2.126 . . . . 0.0 111.474 175.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.454 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 12.7 m-85 -113.11 174.83 5.71 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.421 1.088 . . . . 0.0 110.279 -176.262 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 31.1 p -98.19 173.97 6.75 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.193 0.597 . . . . 0.0 109.812 175.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.515 ' HB2' ' HD2' ' A' ' 95' ' ' ARG . 6.6 tp60 -56.66 -38.94 72.89 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.443 0.697 . . . . 0.0 112.325 -177.042 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -64.24 -48.51 75.52 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.169 0.588 . . . . 0.0 111.404 179.186 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.454 ' HB2' ' HB3' ' A' ' 104' ' ' PHE . 97.0 m -64.85 -36.17 83.47 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.044 0.538 . . . . 0.0 110.91 176.442 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.58 -35.25 78.65 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.824 0.849 . . . . 0.0 110.68 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -77.09 -25.37 52.21 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.784 175.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.87 0 C-N-CA 123.743 0.817 . . . . 0.0 112.098 -179.866 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 . . . . . 0 N--CA 1.485 1.322 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.418 ' O ' ' HB2' ' A' ' 13' ' ' GLU . 88.6 t -60.93 -28.6 43.81 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 CA-C-O 119.064 -0.493 . . . . 0.0 111.826 -176.222 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -59.5 -49.17 78.81 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 174.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.9 m -58.43 -42.45 87.31 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.891 0.876 . . . . 0.0 110.755 179.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -73.16 -32.45 64.87 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.112 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' A' ' 9' ' ' VAL . 3.3 tm-20 -63.99 -54.19 38.26 Favored 'General case' 0 C--O 1.243 0.728 0 C-N-CA 124.535 1.134 . . . . 0.0 109.984 -177.019 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.674 ' HB2' ' HZ3' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -66.6 -45.0 80.61 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 114.396 -1.275 . . . . 0.0 111.406 -177.254 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 10.8 tt -64.77 -33.4 63.14 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 CA-C-N 118.08 0.4 . . . . 0.0 110.713 -175.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.577 ' HB3' HG21 ' A' ' 69' ' ' ILE . 37.5 mt -65.77 -45.29 83.07 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.348 0.659 . . . . 0.0 111.127 175.497 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.508 ' O ' ' HG3' ' A' ' 21' ' ' ARG . 52.1 mtm180 -62.81 -46.47 87.81 Favored 'General case' 0 C--O 1.214 -0.783 0 O-C-N 123.647 0.592 . . . . 0.0 110.986 177.691 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -56.75 -46.97 81.08 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.686 0.795 . . . . 0.0 111.268 176.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? -66.24 -33.11 75.01 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.269 179.186 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.606 ' HB3' HG23 ' A' ' 69' ' ' ILE . 1.3 pt20 -81.78 -22.14 37.35 Favored 'General case' 0 C--O 1.21 -0.985 0 CA-C-O 118.805 -0.617 . . . . 0.0 110.486 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.508 ' HG3' ' O ' ' A' ' 17' ' ' ARG . 82.4 mtt180 -65.08 -49.21 70.91 Favored 'General case' 0 N--CA 1.484 1.273 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 175.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -65.76 -37.54 86.62 Favored 'General case' 0 C--N 1.355 0.84 0 O-C-N 123.962 0.789 . . . . 0.0 110.676 179.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 71.9 mt -69.21 -41.03 77.62 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 122.803 0.441 . . . . 0.0 111.704 177.264 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -63.16 -53.47 52.81 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.369 0.668 . . . . 0.0 109.817 -177.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -66.45 -26.65 67.3 Favored 'General case' 0 N--CA 1.484 1.263 0 O-C-N 123.204 0.315 . . . . 0.0 111.689 178.221 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 17.4 ttm-85 -65.13 -47.97 75.25 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.536 0.734 . . . . 0.0 111.462 176.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.581 HD22 HD21 ' A' ' 66' ' ' LEU . 4.0 pp -82.19 -30.18 31.07 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-O 120.64 0.257 . . . . 0.0 110.557 -178.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 87.8 m-70 . . . . . 0 N--CA 1.481 1.104 0 C-N-CA 123.576 0.75 . . . . 0.0 110.958 174.875 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.437 HD12 HD11 ' A' ' 27' ' ' LEU . 11.1 mt . . . . . 0 CA--C 1.543 0.674 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -86.83 135.77 13.5 Favored Glycine 0 N--CA 1.467 0.723 0 CA-C-O 119.153 -0.804 . . . . 0.0 111.1 173.184 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -56.89 -51.7 68.05 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.441 1.097 . . . . 0.0 111.811 -176.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.5 t -65.34 -33.87 66.62 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 124.133 0.973 . . . . 0.0 110.117 178.212 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.601 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -64.43 -39.96 97.35 Favored Glycine 0 C--O 1.217 -0.927 0 O-C-N 123.487 0.492 . . . . 0.0 111.94 177.474 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -75.66 -38.37 58.84 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.373 1.069 . . . . 0.0 111.484 -178.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -80.75 -36.58 31.77 Favored 'General case' 0 N--CA 1.485 1.316 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.094 -173.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -69.85 -36.08 75.24 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 173.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.601 ' HB2' ' O ' ' A' ' 62' ' ' GLY . 9.5 tp -57.86 -47.57 82.35 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.168 0.987 . . . . 0.0 109.839 171.796 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 38.8 ttt180 -56.92 -44.17 82.17 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.864 1.265 . . . . 0.0 111.193 177.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.8 -38.19 88.3 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.579 0.752 . . . . 0.0 110.749 179.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.606 HG23 ' HB3' ' A' ' 20' ' ' GLN . 74.6 mt -65.78 -50.65 69.37 Favored 'Isoleucine or valine' 0 C--N 1.351 0.647 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.332 177.217 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -68.92 -28.75 66.95 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.176 0.991 . . . . 0.0 111.617 -176.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.32 -44.91 77.99 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.469 0.707 . . . . 0.0 109.621 175.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.492 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -64.48 -45.78 85.86 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 114.76 -1.109 . . . . 0.0 110.633 177.257 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.545 HD23 HD12 ' A' ' 76' ' ' ILE . 92.6 mt -64.16 -34.28 77.7 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 124.479 1.112 . . . . 0.0 111.636 179.041 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.59 -42.17 98.47 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 123.985 0.803 . . . . 0.0 109.947 176.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 58.3 mtp85 -74.72 -25.43 59.12 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 114.804 -1.089 . . . . 0.0 111.881 178.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.545 HD12 HD23 ' A' ' 73' ' ' LEU . 47.6 mt -67.82 -44.93 85.15 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 CA-C-N 118.662 0.664 . . . . 0.0 109.957 175.077 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.34 -39.21 89.74 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 124.085 0.866 . . . . 0.0 110.379 174.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 27.5 t -78.3 -10.72 59.79 Favored 'General case' 0 CA--C 1.555 1.164 0 CA-C-N 115.074 -0.966 . . . . 0.0 111.725 179.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 77.0 10.22 86.37 Favored Glycine 0 C--N 1.351 1.411 0 N-CA-C 113.765 0.266 . . . . 0.0 113.765 178.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 7.5 t -117.87 27.98 8.69 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 124.724 1.21 . . . . 0.0 111.08 -179.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.452 ' HE1' ' HB1' ' A' ' 72' ' ' ALA . 80.1 t80 -53.43 149.14 8.01 Favored 'General case' 0 N--CA 1.485 1.313 0 O-C-N 121.901 -0.499 . . . . 0.0 111.867 170.58 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.532 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 69.52 41.83 75.05 Favored Glycine 0 C--O 1.212 -1.253 0 CA-C-N 114.619 -1.173 . . . . 0.0 111.149 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 31.5 m -124.82 108.75 12.26 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-O 121.265 0.555 . . . . 0.0 109.629 176.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 51.4 t -62.52 98.6 0.12 Allowed 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 114.366 -1.288 . . . . 0.0 110.659 172.085 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 27.5 m -63.65 -23.71 34.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 O-C-N 124.381 1.05 . . . . 0.0 112.374 -175.019 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.482 ' HD3' ' HB3' ' A' ' 108' ' ' CYS . 47.0 tttm -67.76 -26.32 66.06 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.453 0.701 . . . . 0.0 112.046 -177.281 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 31.9 p -133.52 4.25 3.64 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 122.614 0.366 . . . . 0.0 111.648 179.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 61.08 28.42 68.9 Favored Glycine 0 C--N 1.351 1.395 0 N-CA-C 114.483 0.553 . . . . 0.0 114.483 -179.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 46.9 mtmt -116.38 166.27 12.26 Favored 'General case' 0 N--CA 1.487 1.404 0 CA-C-N 117.238 0.519 . . . . 0.0 110.67 -177.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.532 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 7.2 tpp180 -67.21 146.63 54.0 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 124.517 1.127 . . . . 0.0 111.116 177.078 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 10.5 mm -85.77 144.27 9.87 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 170.155 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 5.4 m -67.94 142.19 56.09 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 109.049 -0.722 . . . . 0.0 109.049 176.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -62.29 -29.14 70.22 Favored 'General case' 0 N--CA 1.484 1.272 0 CA-C-N 118.294 0.497 . . . . 0.0 109.976 174.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -57.0 -52.96 63.17 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.534 1.134 . . . . 0.0 111.248 169.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.57 -35.51 80.75 Favored 'General case' 0 C--O 1.214 -0.809 0 O-C-N 124.296 0.997 . . . . 0.0 110.011 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 89.4 mt -72.69 -40.39 66.26 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.467 0.707 . . . . 0.0 111.841 -179.288 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.566 ' HB3' ' HZ3' ' A' ' 97' ' ' LYS . 0.3 OUTLIER -75.01 -28.29 60.46 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.362 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.32 -43.5 50.5 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.973 0.909 . . . . 0.0 110.842 173.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.3 p -151.85 99.73 2.92 Favored Pre-proline 0 CA--C 1.554 1.098 0 C-N-CA 124.6 1.16 . . . . 0.0 108.876 -177.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -66.65 -24.87 47.5 Favored 'Trans proline' 0 C--N 1.373 1.86 0 C-N-CA 122.789 2.326 . . . . 0.0 113.434 179.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 28.4 p90 -93.36 54.63 2.11 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.134 0.974 . . . . 0.0 110.677 -178.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 4.1 t -112.76 103.52 55.61 Favored Pre-proline 0 CA--C 1.554 1.1 0 C-N-CA 123.434 0.694 . . . . 0.0 110.696 -179.066 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -76.26 -9.48 19.02 Favored 'Trans proline' 0 C--N 1.376 1.976 0 C-N-CA 122.852 2.368 . . . . 0.0 112.215 168.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -127.08 117.17 21.9 Favored 'General case' 0 C--N 1.359 1.005 0 C-N-CA 123.501 0.721 . . . . 0.0 110.31 -174.085 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 16.7 p -64.09 159.22 20.81 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 118.145 -0.931 . . . . 0.0 109.28 175.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -44.91 -39.38 5.39 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 124.313 1.045 . . . . 0.0 113.493 -169.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -58.09 -53.79 54.22 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.155 0.982 . . . . 0.0 111.217 176.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.482 ' HB3' ' HD3' ' A' ' 86' ' ' LYS . 85.0 m -73.4 -31.88 64.13 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 114.759 -1.109 . . . . 0.0 111.754 -176.376 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.9 -38.91 92.55 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.127 0.971 . . . . 0.0 110.507 176.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.75 -30.19 62.65 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.489 0.716 . . . . 0.0 110.876 174.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.928 0 C-N-CA 123.822 0.849 . . . . 0.0 112.453 -179.509 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 . . . . . 0 C--O 1.241 0.651 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 60.5 t -67.72 -33.94 64.8 Favored 'Isoleucine or valine' 0 C--N 1.347 0.482 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.225 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -65.34 -30.22 71.04 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 123.836 0.71 . . . . 0.0 111.697 179.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 47.5 m -65.88 -44.23 85.94 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 122.708 0.403 . . . . 0.0 110.061 173.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -67.95 -35.19 77.98 Favored 'General case' 0 C--O 1.217 -0.634 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.51 176.219 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.9 tm-20 -63.59 -55.31 24.77 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.299 1.039 . . . . 0.0 109.41 -176.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.418 ' HB2' ' HE3' ' A' ' 14' ' ' LYS . 15.4 ptmt -71.03 -35.46 71.99 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.252 -173.562 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.493 ' O ' ' HB2' ' A' ' 19' ' ' ARG . 12.3 tt -65.87 -33.95 67.02 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.551 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.555 ' HB3' HG21 ' A' ' 69' ' ' ILE . 69.6 mt -75.58 -34.05 60.64 Favored 'General case' 0 C--N 1.355 0.824 0 C-N-CA 123.952 0.901 . . . . 0.0 111.587 176.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.444 ' NH2' HD13 ' A' ' 73' ' ' LEU . 3.6 mmp_? -58.15 -49.91 75.35 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.097 0.559 . . . . 0.0 109.803 174.665 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -74.95 -27.93 60.38 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.02 0.528 . . . . 0.0 111.381 -179.01 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.493 ' HB2' ' O ' ' A' ' 15' ' ' ILE . 2.3 tpt180 -71.3 -41.98 69.26 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 123.622 0.577 . . . . 0.0 110.101 -178.217 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.56 ' HB3' HG23 ' A' ' 69' ' ' ILE . 2.5 pt20 -72.22 -30.35 64.83 Favored 'General case' 0 C--O 1.206 -1.22 0 CA-C-O 118.834 -0.603 . . . . 0.0 109.665 177.094 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.521 ' HB3' HH21 ' A' ' 25' ' ' ARG . 60.7 mtm-85 -68.43 -46.37 70.06 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.019 0.528 . . . . 0.0 111.999 179.66 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -63.58 -38.24 90.38 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 123.463 0.477 . . . . 0.0 110.428 177.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.553 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 81.5 mt -64.66 -48.77 73.57 Favored 'General case' 0 C--O 1.21 -0.981 0 O-C-N 123.495 0.497 . . . . 0.0 109.927 173.141 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.486 ' CE1' HD22 ' A' ' 66' ' ' LEU . 1.7 m-85 -57.41 -46.38 83.55 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.083 0.953 . . . . 0.0 110.871 -174.196 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.521 HH21 ' HB3' ' A' ' 21' ' ' ARG . 11.0 ptp180 -71.94 -28.11 63.24 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 122.747 0.419 . . . . 0.0 111.321 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 38.8 ttm180 -68.39 -56.52 8.21 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.435 0.694 . . . . 0.0 111.265 175.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.553 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 3.5 pp -80.88 -25.93 37.25 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.386 0.674 . . . . 0.0 111.51 -171.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.46 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 75.6 m-70 . . . . . 0 N--CA 1.483 1.189 0 C-N-CA 122.866 0.466 . . . . 0.0 110.109 169.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.468 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 50.0 mt . . . . . 0 CA--C 1.55 0.959 0 N-CA-C 110.516 -0.179 . . . . 0.0 110.516 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 151.07 139.75 3.05 Favored Glycine 0 C--N 1.346 1.1 0 CA-C-O 119.711 -0.494 . . . . 0.0 111.889 -178.532 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -57.2 -63.89 1.07 Allowed 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.774 1.23 . . . . 0.0 113.18 -170.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 60.4 t -59.82 -33.81 53.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 C-N-CA 124.39 1.076 . . . . 0.0 110.759 -177.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.525 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -63.68 -54.96 27.81 Favored Glycine 0 C--O 1.215 -1.082 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.766 177.232 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -67.87 -37.42 81.79 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 124.363 1.065 . . . . 0.0 112.092 -174.058 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -67.81 -46.07 72.96 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 123.901 0.75 . . . . 0.0 110.472 -179.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -70.17 -35.08 73.74 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.1 178.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.525 ' HB2' ' O ' ' A' ' 62' ' ' GLY . 11.9 tp -60.3 -46.3 90.36 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 124.943 1.297 . . . . 0.0 110.459 -179.306 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -66.64 -39.74 88.41 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 124.632 1.207 . . . . 0.0 110.674 178.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.03 -39.99 95.32 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.673 0.789 . . . . 0.0 110.849 179.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.56 HG23 ' HB3' ' A' ' 20' ' ' GLN . 89.4 mt -66.87 -46.03 86.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-N 114.841 -1.072 . . . . 0.0 109.745 176.361 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -65.03 -33.12 75.28 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.063 0.945 . . . . 0.0 111.271 -177.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.58 -44.07 75.18 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.626 0.77 . . . . 0.0 110.275 178.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.423 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -63.45 -49.97 71.56 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.893 178.573 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.444 HD13 ' NH2' ' A' ' 17' ' ' ARG . 69.1 mt -61.23 -38.24 85.93 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.805 1.242 . . . . 0.0 112.246 179.038 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.55 -42.54 98.99 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.423 0.689 . . . . 0.0 110.485 177.338 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 86.8 mtt-85 -75.24 -21.85 58.29 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 114.761 -1.109 . . . . 0.0 112.369 -178.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.44 HD13 HD21 ' A' ' 73' ' ' LEU . 89.6 mt -67.24 -47.82 80.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 171.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -67.2 -30.64 70.64 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.362 178.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 29.1 t -80.48 -23.6 40.06 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.652 0.781 . . . . 0.0 111.113 177.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 87.99 7.29 74.29 Favored Glycine 0 C--N 1.35 1.333 0 C-N-CA 123.039 0.352 . . . . 0.0 113.657 -178.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.3 t -113.12 29.03 8.31 Favored 'General case' 0 CA--C 1.556 1.2 0 C-N-CA 124.082 0.953 . . . . 0.0 110.413 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -64.22 146.12 54.83 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 122.729 0.412 . . . . 0.0 110.413 169.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.485 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 74.36 31.32 59.28 Favored Glycine 0 C--N 1.341 0.842 0 O-C-N 123.82 0.7 . . . . 0.0 112.298 -177.748 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 26.6 m -117.89 110.85 18.25 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 122.887 0.475 . . . . 0.0 110.215 176.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . 0.436 ' HA ' ' O ' ' A' ' 103' ' ' PRO . 44.0 t -77.57 95.64 4.59 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.154 0.981 . . . . 0.0 110.101 174.728 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 30.9 m -62.56 -30.77 49.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 O-C-N 124.138 0.898 . . . . 0.0 113.077 -175.44 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.527 ' HD2' ' HB3' ' A' ' 108' ' ' CYS . 22.7 ttmm -60.56 -32.19 71.28 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.439 0.696 . . . . 0.0 112.535 -176.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.539 ' SG ' ' HB2' ' A' ' 89' ' ' LYS . 28.7 p -119.83 1.73 11.02 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 122.45 0.3 . . . . 0.0 111.273 175.342 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 62.76 20.82 62.38 Favored Glycine 0 C--N 1.351 1.39 0 CA-C-O 120.065 -0.297 . . . . 0.0 113.388 -177.069 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.539 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 11.0 mmpt? -106.46 177.06 4.97 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.48 0.712 . . . . 0.0 110.534 -176.689 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.485 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 21.8 tpp85 -78.83 144.97 34.53 Favored 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 124.197 0.999 . . . . 0.0 110.415 177.409 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 5.3 mm -79.94 144.89 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 168.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 19.7 m -74.55 149.31 40.23 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 110.403 -0.221 . . . . 0.0 110.403 178.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.428 ' HG2' ' HE3' ' A' ' 97' ' ' LYS . 30.6 tt0 -60.07 -42.96 95.68 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.854 0.862 . . . . 0.0 110.598 174.09 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -57.21 -43.7 83.03 Favored 'General case' 0 N--CA 1.482 1.151 0 O-C-N 124.497 1.123 . . . . 0.0 110.546 176.414 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.524 ' HG3' HG23 ' A' ' 102' ' ' THR . 26.5 tpt180 -64.43 -43.37 94.54 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 114.488 -1.233 . . . . 0.0 110.869 179.074 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 75.2 mt -71.46 -33.68 69.54 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.302 0.641 . . . . 0.0 112.624 -176.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.428 ' HE3' ' HG2' ' A' ' 93' ' ' GLU . 16.4 ptpt -79.75 -27.74 40.51 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 122.248 -0.283 . . . . 0.0 110.56 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -80.34 -33.66 37.22 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.859 0.864 . . . . 0.0 111.21 177.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.4 p -157.57 97.04 1.98 Allowed Pre-proline 0 CA--C 1.556 1.197 0 C-N-CA 124.78 1.232 . . . . 0.0 108.248 179.187 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . 0.422 ' HG2' HD22 ' A' ' 16' ' ' LEU . 64.5 Cg_endo -75.28 -8.81 20.06 Favored 'Trans proline' 0 C--N 1.377 2.067 0 C-N-CA 122.671 2.248 . . . . 0.0 113.724 -179.342 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 35.1 p90 -105.74 45.6 0.96 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.434 0.693 . . . . 0.0 110.991 -178.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' THR . . . . . 0.524 HG23 ' HG3' ' A' ' 95' ' ' ARG . 15.2 t -116.92 101.79 53.28 Favored Pre-proline 0 CA--C 1.564 1.508 0 CA-C-O 121.149 0.5 . . . . 0.0 110.216 -178.56 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . 0.436 ' O ' ' HA ' ' A' ' 84' ' ' CYS . 32.4 Cg_exo -64.83 -24.54 61.22 Favored 'Trans proline' 0 C--N 1.378 2.109 0 C-N-CA 122.898 2.399 . . . . 0.0 113.317 174.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.403 ' HA ' ' SG ' ' A' ' 84' ' ' CYS . 6.6 m-85 -114.64 148.74 37.71 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.833 0.853 . . . . 0.0 109.297 -178.694 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.502 ' SG ' ' OE1' ' A' ' 107' ' ' GLU . 28.5 p -83.54 165.7 18.87 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 -178.482 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -46.78 -41.86 16.06 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 124.793 1.237 . . . . 0.0 114.204 -162.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.502 ' OE1' ' SG ' ' A' ' 105' ' ' CYS . 0.0 OUTLIER -82.95 -23.61 33.37 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-O 120.647 0.261 . . . . 0.0 111.556 -175.982 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.527 ' HB3' ' HD2' ' A' ' 86' ' ' LYS . 97.7 m -76.54 -29.83 56.87 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.23 1.012 . . . . 0.0 110.951 174.288 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -78.13 -34.57 49.84 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.505 0.722 . . . . 0.0 109.866 174.46 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.55 -21.72 61.12 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.874 0.87 . . . . 0.0 111.151 174.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.773 0 C-N-CA 123.778 0.831 . . . . 0.0 111.733 176.248 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 62.6 t30 . . . . . 0 N--CA 1.478 0.936 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 99.4 t -59.4 -34.0 53.0 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.079 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.145 177.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -58.4 -43.81 88.76 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 124.465 1.106 . . . . 0.0 112.249 -179.294 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.9 m -57.68 -40.38 79.29 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.031 0.532 . . . . 0.0 110.262 177.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.469 ' HA ' HG22 ' A' ' 15' ' ' ILE . 25.2 m-85 -75.62 -34.81 60.59 Favored 'General case' 0 C--O 1.214 -0.799 0 CA-C-N 115.1 -0.955 . . . . 0.0 110.816 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -57.53 -53.23 60.45 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.407 1.083 . . . . 0.0 110.089 -177.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.479 ' HZ1' ' HB2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -71.72 -42.75 66.93 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.711 -176.701 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.469 HG22 ' HA ' ' A' ' 12' ' ' TYR . 11.6 tt -62.92 -34.25 65.11 Favored 'Isoleucine or valine' 0 C--N 1.37 1.489 0 CA-C-N 118.588 0.631 . . . . 0.0 110.083 -177.13 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.569 ' HB3' HG21 ' A' ' 69' ' ' ILE . 56.9 mt -65.13 -43.2 92.69 Favored 'General case' 0 C--N 1.345 0.406 0 C-N-CA 123.224 0.609 . . . . 0.0 110.898 175.827 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.411 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 97.4 mtt180 -63.87 -47.46 80.57 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 123.717 0.636 . . . . 0.0 111.88 177.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -63.71 -42.57 97.93 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 122.976 0.51 . . . . 0.0 111.204 -178.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -39.97 81.05 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.786 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.627 ' HB3' HG23 ' A' ' 69' ' ' ILE . 2.2 pt20 -70.16 -35.37 73.96 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 119.301 -0.381 . . . . 0.0 110.535 -178.706 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 71.1 mtp180 -69.47 -41.5 76.12 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.588 0.755 . . . . 0.0 111.363 -175.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -66.68 -34.41 77.81 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 175.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.592 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 86.1 mt -69.42 -38.53 77.94 Favored 'General case' 0 C--O 1.216 -0.671 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.924 174.763 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -60.85 -46.31 91.09 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 122.992 0.517 . . . . 0.0 110.304 -177.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 -69.95 -31.52 69.3 Favored 'General case' 0 N--CA 1.483 1.197 0 O-C-N 123.492 0.495 . . . . 0.0 110.634 178.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 21.7 ttt85 -62.38 -59.48 4.94 Favored 'General case' 0 C--N 1.361 1.091 0 C-N-CA 123.533 0.733 . . . . 0.0 111.439 177.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 1.1 pp -80.19 -24.48 40.28 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 112.505 0.558 . . . . 0.0 112.505 -173.36 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 . . . . . 0 N--CA 1.494 1.745 0 C-N-CA 123.04 0.536 . . . . 0.0 109.693 174.436 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.8 mt . . . . . 0 N--CA 1.472 0.651 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -70.3 149.08 46.68 Favored Glycine 0 N--CA 1.472 1.087 0 CA-C-O 119.227 -0.763 . . . . 0.0 112.45 -177.234 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -50.72 -60.31 3.18 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.725 1.21 . . . . 0.0 112.51 -175.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.414 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 12.4 p -56.81 -35.03 44.95 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 123.202 0.601 . . . . 0.0 111.377 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -67.86 -41.13 88.98 Favored Glycine 0 C--N 1.347 1.165 0 O-C-N 123.883 0.739 . . . . 0.0 112.665 177.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -68.87 -43.78 74.64 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.629 0.771 . . . . 0.0 110.695 -177.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -68.2 -33.09 73.78 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.588 0.755 . . . . 0.0 110.749 178.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.414 ' HB2' ' O ' ' A' ' 61' ' ' VAL . 2.7 tp10 -69.79 -46.75 65.05 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.609 179.608 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.7 mp -60.59 -39.44 88.1 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 124.356 1.035 . . . . 0.0 110.47 174.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 74.0 ttt180 -64.24 -39.61 94.31 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.311 -179.124 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.19 -43.11 65.02 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.921 0.889 . . . . 0.0 110.985 178.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.627 HG23 ' HB3' ' A' ' 20' ' ' GLN . 69.9 mt -64.5 -55.86 19.22 Favored 'Isoleucine or valine' 0 C--N 1.356 0.855 0 C-N-CA 123.507 0.723 . . . . 0.0 110.174 -177.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -66.71 -25.29 66.45 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.089 0.955 . . . . 0.0 112.304 -179.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.403 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -65.17 -51.93 58.09 Favored 'General case' 0 N--CA 1.482 1.175 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 171.07 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.516 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -60.43 -42.42 96.03 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.317 1.047 . . . . 0.0 111.007 -179.042 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.474 HD22 HD13 ' A' ' 76' ' ' ILE . 88.1 mt -64.19 -39.41 93.94 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 124.56 1.144 . . . . 0.0 111.619 178.537 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.12 -37.66 88.17 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.383 0.673 . . . . 0.0 110.558 175.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.403 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 69.6 mtt-85 -73.05 -26.44 61.29 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.701 0.8 . . . . 0.0 111.055 178.494 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 72' ' ' ALA . 90.0 mt -66.33 -48.76 79.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 174.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.62 -35.17 80.04 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.909 179.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.8 t -78.19 -14.94 59.25 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 123.794 0.837 . . . . 0.0 111.437 177.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 82.23 6.19 88.99 Favored Glycine 0 C--N 1.351 1.385 0 C-N-CA 123.24 0.448 . . . . 0.0 113.908 177.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.5 t -104.28 15.17 28.87 Favored 'General case' 0 CA--C 1.555 1.172 0 C-N-CA 124.311 1.045 . . . . 0.0 111.323 -177.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -67.16 151.85 46.81 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 169.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 72.29 20.58 79.3 Favored Glycine 0 C--N 1.344 1.009 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.775 -176.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 30.5 m -128.12 111.37 13.4 Favored 'General case' 0 C--N 1.353 0.742 0 C-N-CA 124.179 0.992 . . . . 0.0 109.65 178.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 44.2 t -72.71 93.18 1.62 Allowed 'General case' 0 C--O 1.244 0.769 0 C-N-CA 123.878 0.871 . . . . 0.0 110.094 173.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 25.6 m -61.07 -24.4 32.97 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 CA-C-N 114.438 -1.255 . . . . 0.0 112.843 -178.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 47.7 tttm -71.9 -14.79 62.04 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.055 0.542 . . . . 0.0 112.116 -176.204 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.477 ' SG ' ' HB2' ' A' ' 89' ' ' LYS . 27.7 p -137.11 5.57 2.79 Favored 'General case' 0 N--CA 1.486 1.374 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 173.322 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 65.04 17.2 63.07 Favored Glycine 0 C--N 1.357 1.728 0 N-CA-C 113.819 0.288 . . . . 0.0 113.819 -178.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.477 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 31.8 mmmt -101.34 165.19 11.4 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.756 0.822 . . . . 0.0 109.415 -179.028 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 25.6 mmt180 -80.41 149.6 30.1 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 123.001 0.521 . . . . 0.0 110.42 172.079 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 5.3 mm -78.16 145.62 9.5 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 172.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 17.2 m -75.21 151.39 38.45 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.127 0.571 . . . . 0.0 109.744 177.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -64.25 -41.06 97.12 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 122.624 0.37 . . . . 0.0 110.672 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.452 ' HA ' ' HG2' ' A' ' 97' ' ' LYS . 24.7 m-20 -71.44 -31.71 67.51 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 123.771 0.67 . . . . 0.0 111.213 -179.465 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 29.0 tpt180 -64.02 -37.17 86.44 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.433 0.693 . . . . 0.0 110.588 170.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 55.6 mt -77.68 -40.91 39.96 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.175 0.59 . . . . 0.0 112.278 -178.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.452 ' HG2' ' HA ' ' A' ' 94' ' ' ASP . 15.2 ptpt -70.79 -27.61 64.04 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-O 120.757 0.313 . . . . 0.0 110.223 -177.295 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.7 -50.69 8.99 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.693 0.797 . . . . 0.0 110.755 173.234 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -130.2 86.0 55.34 Favored Pre-proline 0 CA--C 1.558 1.275 0 C-N-CA 124.087 0.955 . . . . 0.0 108.724 -175.449 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -77.89 -7.15 16.37 Favored 'Trans proline' 0 C--N 1.37 1.707 0 C-N-CA 122.383 2.055 . . . . 0.0 114.077 -177.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 16.3 p90 -103.12 -8.63 20.34 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -176.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 15.1 t -73.5 125.28 90.74 Favored Pre-proline 0 CA--C 1.56 1.331 0 CA-C-N 117.896 0.316 . . . . 0.0 110.398 -175.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -79.15 -7.91 15.25 Favored 'Trans proline' 0 C--N 1.371 1.724 0 C-N-CA 122.517 2.145 . . . . 0.0 111.98 172.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -116.32 140.08 49.71 Favored 'General case' 0 C--N 1.353 0.723 0 C-N-CA 123.855 0.862 . . . . 0.0 110.281 -175.157 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 20.6 p -75.43 167.09 22.56 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 174.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -50.55 -41.49 54.19 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.798 0.839 . . . . 0.0 112.106 -174.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -65.48 -44.27 87.64 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.2 1.0 . . . . 0.0 110.396 -175.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 86.8 m -69.26 -39.34 78.49 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.23 0.612 . . . . 0.0 111.103 177.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.88 -30.99 71.68 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.576 0.75 . . . . 0.0 111.399 177.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -74.46 -34.69 63.21 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.893 0.877 . . . . 0.0 110.598 174.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.548 0.893 0 C-N-CA 123.881 0.872 . . . . 0.0 111.939 178.489 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 15.9 p-10 . . . . . 0 CA--C 1.548 0.874 0 CA-C-O 121.9 0.857 . . . . 0.0 110.273 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 42.5 t -69.69 -27.56 34.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.485 -179.302 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -52.98 -38.49 62.24 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.073 0.949 . . . . 0.0 111.695 179.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 16.6 m -60.42 -43.48 96.71 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.932 175.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -72.18 -32.69 67.05 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.996 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.52 ' HG2' HD11 ' A' ' 76' ' ' ILE . 39.5 mt-10 -59.3 -56.25 24.44 Favored 'General case' 0 N--CA 1.492 1.636 0 CA-C-O 121.434 0.635 . . . . 0.0 110.809 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -66.47 -44.44 82.71 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.134 -176.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 10.3 tt -67.49 -32.7 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.242 0 C-N-CA 122.514 0.326 . . . . 0.0 110.574 -174.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.527 ' HB3' HG21 ' A' ' 69' ' ' ILE . 31.2 mt -65.2 -46.09 82.15 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.093 0.557 . . . . 0.0 110.635 175.103 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 51.2 mtm-85 -63.82 -41.91 97.77 Favored 'General case' 0 C--O 1.217 -0.628 0 O-C-N 123.605 0.566 . . . . 0.0 110.81 179.402 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -61.54 -36.27 80.1 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.317 0.647 . . . . 0.0 111.218 177.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -81.15 -28.84 34.89 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.258 -178.535 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.588 ' HB3' HG23 ' A' ' 69' ' ' ILE . 2.4 pt20 -78.04 -25.09 47.62 Favored 'General case' 0 C--O 1.207 -1.16 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 173.546 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 72.9 mtt180 -66.82 -49.48 65.67 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.056 0.542 . . . . 0.0 110.589 176.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -65.75 -37.46 86.42 Favored 'General case' 0 N--CA 1.478 0.968 0 O-C-N 123.533 0.521 . . . . 0.0 110.88 178.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.581 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 58.0 mt -67.96 -46.23 71.97 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 119.155 -0.45 . . . . 0.0 111.147 175.411 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.422 ' O ' ' HB2' ' A' ' 28' ' ' HIS . 3.8 m-85 -58.13 -50.53 73.18 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.173 0.589 . . . . 0.0 110.094 -177.579 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 19.7 ptt180 -68.79 -28.15 66.51 Favored 'General case' 0 N--CA 1.48 1.057 0 O-C-N 123.525 0.515 . . . . 0.0 111.172 -178.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 14.8 ttm180 -62.97 -59.05 5.35 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.083 0.553 . . . . 0.0 110.403 175.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.581 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 1.6 pp -80.99 -8.37 59.76 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.986 -176.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.422 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 17.9 m170 . . . . . 0 N--CA 1.479 0.997 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 170.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.447 ' HA ' ' HB2' ' A' ' 27' ' ' LEU . 4.6 mt . . . . . 0 N--CA 1.476 0.86 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -97.53 161.71 21.36 Favored Glycine 0 N--CA 1.478 1.452 0 CA-C-O 119.493 -0.615 . . . . 0.0 112.181 173.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -64.77 -64.3 0.91 Allowed 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.231 0.612 . . . . 0.0 111.722 -173.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 9.3 p -59.32 -29.76 42.64 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 C-N-CA 123.89 0.876 . . . . 0.0 110.726 177.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.518 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -60.45 -51.73 56.96 Favored Glycine 0 C--N 1.348 1.25 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.164 175.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -69.9 -40.72 75.45 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.714 0.806 . . . . 0.0 112.024 -177.307 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -67.04 -44.05 81.19 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 123.92 0.763 . . . . 0.0 110.264 -174.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -70.43 -38.44 74.57 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.235 177.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' A' ' 62' ' ' GLY . 14.9 tp -58.23 -46.26 86.22 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 124.738 1.215 . . . . 0.0 111.137 178.525 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 31.1 ttt180 -75.94 -31.84 59.28 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 114.004 -1.453 . . . . 0.0 110.024 -175.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -68.28 -39.35 82.17 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 123.915 0.759 . . . . 0.0 110.717 174.533 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.588 HG23 ' HB3' ' A' ' 20' ' ' GLN . 80.9 mt -63.51 -47.7 90.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.523 0.729 . . . . 0.0 109.569 175.46 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -63.37 -35.59 80.91 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.813 -179.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.15 -39.99 75.02 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.757 0.823 . . . . 0.0 110.971 177.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.494 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -68.1 -43.3 78.78 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.61 0.764 . . . . 0.0 110.746 -179.699 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 84.7 mt -61.38 -39.11 89.46 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.288 1.035 . . . . 0.0 111.164 175.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.61 -37.12 86.49 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.624 175.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 67.3 mtt85 -69.98 -29.04 66.03 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.599 0.76 . . . . 0.0 111.509 176.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.52 HD11 ' HG2' ' A' ' 13' ' ' GLU . 62.3 mt -70.3 -44.79 77.3 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 177.394 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.89 -27.41 67.48 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 115.329 -0.851 . . . . 0.0 111.218 176.513 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.9 t -84.13 -18.23 37.46 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.729 0.812 . . . . 0.0 110.804 174.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 82.42 7.94 86.91 Favored Glycine 0 C--N 1.348 1.229 0 C-N-CA 123.084 0.373 . . . . 0.0 113.937 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.2 t -112.95 31.32 6.49 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 124.196 0.998 . . . . 0.0 110.402 -179.029 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -64.5 146.55 54.39 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.714 170.509 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.47 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 73.16 37.03 55.76 Favored Glycine 0 C--N 1.343 0.933 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.955 -177.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 41.0 m -121.73 116.27 24.21 Favored 'General case' 0 C--O 1.242 0.679 0 C-N-CA 123.279 0.632 . . . . 0.0 109.668 177.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 44.4 t -67.33 102.29 1.07 Allowed 'General case' 0 C--N 1.349 0.563 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 169.076 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 33.7 m -63.43 -30.28 49.39 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 O-C-N 124.242 0.964 . . . . 0.0 111.947 -177.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -73.66 -13.7 61.03 Favored 'General case' 0 CA--C 1.557 1.241 0 C-N-CA 123.609 0.763 . . . . 0.0 111.432 177.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 57.5 m -111.17 -23.29 10.96 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.768 0.827 . . . . 0.0 111.534 175.038 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 64.56 20.87 66.34 Favored Glycine 0 CA--C 1.537 1.464 0 CA-C-N 116.545 -0.298 . . . . 0.0 112.986 -165.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 46.6 mtmt -126.89 -177.56 4.07 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.978 0.911 . . . . 0.0 110.491 -172.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.47 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 18.7 tpp180 -72.9 152.67 41.34 Favored 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 124.663 1.185 . . . . 0.0 111.658 -178.192 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 17.6 mm -92.72 149.68 4.11 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.017 0 C-N-CA 124.978 1.311 . . . . 0.0 109.406 170.371 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.3 m -64.59 145.13 56.61 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 122.965 0.506 . . . . 0.0 110.25 174.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -58.5 -42.81 88.51 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.257 0.623 . . . . 0.0 110.839 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.492 ' HA ' ' HG2' ' A' ' 97' ' ' LYS . 16.2 m-20 -68.31 -33.11 73.73 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.83 -179.659 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.405 ' HG3' HG23 ' A' ' 102' ' ' THR . 24.6 tpt180 -68.35 -31.78 71.42 Favored 'General case' 0 CA--C 1.547 0.864 0 O-C-N 123.635 0.584 . . . . 0.0 110.217 173.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 90.9 mt -80.34 -37.06 33.21 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 118.189 0.45 . . . . 0.0 112.171 179.447 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.492 ' HG2' ' HA ' ' A' ' 94' ' ' ASP . 16.5 ptpt -75.32 -28.66 59.74 Favored 'General case' 0 N--CA 1.485 1.296 0 CA-C-O 120.882 0.373 . . . . 0.0 110.077 -177.514 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -91.37 -41.37 10.94 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.721 0.809 . . . . 0.0 111.296 178.736 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 3.8 t -132.54 76.04 72.49 Favored Pre-proline 0 CA--C 1.56 1.357 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 -175.516 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -74.02 0.9 7.77 Favored 'Trans proline' 0 C--N 1.373 1.84 0 C-N-CA 122.579 2.186 . . . . 0.0 114.123 -174.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 22.8 p90 -108.18 -8.61 15.72 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.445 0.698 . . . . 0.0 112.599 -176.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' THR . . . . . 0.405 HG23 ' HG3' ' A' ' 95' ' ' ARG . 14.7 t -65.62 123.18 83.91 Favored Pre-proline 0 CA--C 1.566 1.578 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -170.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -76.47 -19.23 15.05 Favored 'Trans proline' 0 C--N 1.377 2.05 0 C-N-CA 122.482 2.121 . . . . 0.0 112.041 171.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -113.02 162.93 15.32 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.848 0.859 . . . . 0.0 109.766 -176.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 31.1 p -92.32 168.38 11.35 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 175.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -55.13 -32.46 62.09 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.618 0.767 . . . . 0.0 111.905 -178.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -67.74 -45.29 75.4 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.757 0.823 . . . . 0.0 109.917 178.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 91.6 m -69.65 -30.61 68.34 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.411 177.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.0 -32.4 74.1 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.419 0.688 . . . . 0.0 110.772 173.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -80.79 -21.16 41.2 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.588 0.755 . . . . 0.0 111.3 173.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.142 0 C-N-CA 123.745 0.818 . . . . 0.0 112.47 -178.718 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 16.4 m120 . . . . . 0 N--CA 1.473 0.703 0 CA-C-O 121.699 0.761 . . . . 0.0 109.054 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 44.3 t -65.24 -26.04 38.71 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-N 114.35 -1.295 . . . . 0.0 111.795 -170.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -61.87 -31.02 71.26 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.351 0.66 . . . . 0.0 112.572 179.353 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.4 m -66.96 -40.24 87.44 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 121.395 0.617 . . . . 0.0 109.869 172.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -72.64 -30.24 64.14 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.749 178.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.485 ' HG2' HD12 ' A' ' 76' ' ' ILE . 41.2 mt-10 -66.49 -52.44 45.97 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 122.95 0.5 . . . . 0.0 110.385 -179.254 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -65.39 -41.56 93.58 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 123.938 0.774 . . . . 0.0 111.687 -176.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 12.0 tt -65.0 -34.82 73.2 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 CA-C-O 120.727 0.298 . . . . 0.0 110.281 -178.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.5 mt -69.24 -38.26 78.4 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 122.77 0.428 . . . . 0.0 111.119 176.161 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -58.83 -50.41 74.09 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.005 0.522 . . . . 0.0 110.268 175.276 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -61.35 -47.9 83.76 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.451 0.7 . . . . 0.0 111.669 -179.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.77 -40.69 98.08 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.452 0.701 . . . . 0.0 111.404 -178.203 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.578 ' HB3' HG21 ' A' ' 69' ' ' ILE . 3.0 pt20 -76.05 -32.34 59.26 Favored 'General case' 0 C--O 1.214 -0.815 0 CA-C-O 119.045 -0.502 . . . . 0.0 111.432 -177.698 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.0 mmt180 -76.24 -36.01 58.71 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 117.97 0.35 . . . . 0.0 111.365 -176.024 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -67.93 -41.19 82.96 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 174.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.507 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 75.6 mt -65.5 -43.02 91.47 Favored 'General case' 0 C--N 1.354 0.78 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.391 174.39 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -58.36 -54.0 51.98 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.862 0.865 . . . . 0.0 110.702 -175.561 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.9 ptt180 -69.11 -27.61 65.73 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 123.742 0.651 . . . . 0.0 111.224 -178.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 44.0 ttt85 -66.23 -58.32 5.65 Favored 'General case' 0 C--N 1.362 1.11 0 C-N-CA 122.919 0.488 . . . . 0.0 111.269 176.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.608 HD23 HD21 ' A' ' 66' ' ' LEU . 4.0 pp -72.76 -26.52 61.58 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 122.86 0.464 . . . . 0.0 111.022 -175.611 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 42.9 m-70 . . . . . 0 N--CA 1.484 1.25 0 C-N-CA 123.095 0.558 . . . . 0.0 111.376 173.012 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.44 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 59.8 mt . . . . . 0 CA--C 1.546 0.82 0 N-CA-C 110.597 -0.149 . . . . 0.0 110.597 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 129.7 124.7 2.65 Favored Glycine 0 N--CA 1.474 1.227 0 N-CA-C 111.375 -0.69 . . . . 0.0 111.375 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -66.05 -38.19 87.73 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -164.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 6.1 p -62.36 -39.4 84.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 CA-C-N 118.399 0.545 . . . . 0.0 110.692 177.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.477 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -66.39 -49.89 53.66 Favored Glycine 0 C--N 1.344 0.98 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.632 176.463 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -67.23 -35.72 80.14 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 124.593 1.157 . . . . 0.0 112.24 -174.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -73.11 -48.69 33.52 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.577 -176.063 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -64.96 -34.57 78.73 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 115.013 -0.994 . . . . 0.0 109.74 177.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.608 HD21 HD23 ' A' ' 27' ' ' LEU . 13.9 tp -60.84 -46.02 92.23 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.691 1.197 . . . . 0.0 109.911 175.517 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 51.7 ttt180 -61.92 -38.09 87.12 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.172 0.989 . . . . 0.0 110.93 -178.469 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.16 -43.26 99.17 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 123.81 0.694 . . . . 0.0 110.253 176.093 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.578 HG21 ' HB3' ' A' ' 20' ' ' GLN . 85.1 mt -65.2 -45.49 93.69 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.871 179.076 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -66.14 -33.09 74.98 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.912 0.885 . . . . 0.0 111.123 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.58 -35.89 73.28 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.093 0.957 . . . . 0.0 110.243 177.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.429 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -68.44 -47.28 67.59 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.64 177.348 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.491 HD22 HD13 ' A' ' 76' ' ' ILE . 88.2 mt -63.24 -33.76 76.19 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 124.192 0.997 . . . . 0.0 111.491 177.115 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.0 -41.24 95.57 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.667 0.787 . . . . 0.0 110.355 175.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 89.1 mtm180 -68.82 -30.43 68.97 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.382 0.673 . . . . 0.0 111.604 176.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.491 HD13 HD22 ' A' ' 73' ' ' LEU . 75.1 mt -68.99 -42.63 82.22 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 176.499 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.53 -34.25 77.81 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.767 176.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.8 t -82.0 -12.79 58.14 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 124.035 0.934 . . . . 0.0 111.114 178.268 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 75.71 9.64 84.88 Favored Glycine 0 C--N 1.353 1.521 0 C-N-CA 123.086 0.375 . . . . 0.0 113.627 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 15.2 t -112.42 28.18 9.0 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.24 1.016 . . . . 0.0 109.774 -177.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.415 ' HE1' ' HB2' ' A' ' 72' ' ' ALA . 58.8 t80 -66.45 144.41 56.51 Favored 'General case' 0 C--N 1.348 0.527 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.901 172.291 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.535 ' HA2' HD22 ' A' ' 96' ' ' LEU . . . 77.87 37.27 30.12 Favored Glycine 0 C--N 1.34 0.77 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.769 -172.256 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 93.9 m -123.79 118.26 26.77 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.557 0.743 . . . . 0.0 110.586 177.181 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . 0.698 ' SG ' ' SG ' ' A' ' 87' ' ' CYS . 48.8 t -62.02 92.85 0.04 OUTLIER 'General case' 0 C--N 1.352 0.699 0 C-N-CA 124.927 1.291 . . . . 0.0 108.239 166.725 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 33.1 m -62.88 -27.33 42.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 124.003 0.921 . . . . 0.0 112.25 -173.211 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 59.4 tttm -70.48 -20.63 62.85 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.25 1.02 . . . . 0.0 111.573 178.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.698 ' SG ' ' SG ' ' A' ' 84' ' ' CYS . 11.8 m -120.48 -13.54 8.79 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 123.959 0.903 . . . . 0.0 111.342 -174.172 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 60.83 31.6 76.42 Favored Glycine 0 C--N 1.353 1.473 0 CA-C-N 116.48 -0.327 . . . . 0.0 113.266 -173.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -135.74 -174.49 3.67 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.761 0.824 . . . . 0.0 110.691 -176.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.465 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 4.3 tpp180 -74.7 151.93 39.17 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.854 0.862 . . . . 0.0 112.918 -169.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 23.9 mm -95.48 148.85 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 124.345 1.058 . . . . 0.0 108.513 167.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.4 m -71.75 145.46 48.74 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.643 0.777 . . . . 0.0 110.05 177.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -58.32 -41.03 83.65 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.245 0.618 . . . . 0.0 110.929 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -62.55 -38.97 92.11 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.324 1.05 . . . . 0.0 111.101 179.318 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.4 ' HE ' HG22 ' A' ' 102' ' ' THR . 25.5 tpt180 -69.66 -33.46 72.62 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.74 178.604 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.535 HD22 ' HA2' ' A' ' 82' ' ' GLY . 87.0 mt -73.17 -45.23 57.77 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 122.817 0.447 . . . . 0.0 111.421 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -71.32 -28.46 64.11 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 122.808 0.443 . . . . 0.0 110.938 -175.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -88.34 -47.16 8.6 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.336 0.654 . . . . 0.0 111.058 178.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 1.7 t -129.87 79.66 72.81 Favored Pre-proline 0 CA--C 1.559 1.308 0 C-N-CA 124.029 0.931 . . . . 0.0 108.639 -175.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -73.37 -8.17 21.45 Favored 'Trans proline' 0 C--N 1.372 1.774 0 C-N-CA 122.285 1.99 . . . . 0.0 113.445 -177.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 26.6 p90 -100.86 -8.69 22.35 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -176.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' THR . . . . . 0.4 HG22 ' HE ' ' A' ' 95' ' ' ARG . 13.8 t -62.06 122.17 70.57 Favored Pre-proline 0 CA--C 1.563 1.443 0 O-C-N 123.129 0.268 . . . . 0.0 111.365 -172.152 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -66.44 -37.85 21.75 Favored 'Trans proline' 0 C--N 1.376 2.026 0 C-N-CA 122.461 2.107 . . . . 0.0 111.371 173.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -99.57 -179.49 4.22 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.694 -178.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.752 ' SG ' ' HB2' ' A' ' 108' ' ' CYS . 15.0 p -98.71 179.64 4.6 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 124.875 1.27 . . . . 0.0 109.227 173.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -64.86 -55.51 19.04 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 118.051 0.387 . . . . 0.0 111.459 -177.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.06 -34.25 76.08 Favored 'General case' 0 N--CA 1.483 1.225 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -175.068 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.752 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 68.3 m -81.04 -22.95 38.91 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 179.433 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -78.74 -24.23 44.94 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 171.439 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -81.87 -27.4 33.5 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.605 0.762 . . . . 0.0 110.797 172.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.677 0 C-N-CA 124.137 0.975 . . . . 0.0 109.959 -179.859 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 8.2 tt . . . . . 0 N--CA 1.478 0.971 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -78.98 99.12 6.7 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 174.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -157.71 73.19 0.23 Allowed Glycine 0 C--N 1.345 1.083 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -178.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -76.73 -35.38 40.56 Favored Glycine 0 C--N 1.347 1.192 0 O-C-N 123.837 0.375 . . . . 0.0 113.043 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -83.75 156.68 22.43 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.318 0.647 . . . . 0.0 110.472 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 67.4 m 68.69 134.88 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.635 1.574 . . . . 0.0 112.122 -176.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' MET . . . . . 0.468 ' HG3' HD11 ' A' ' 96' ' ' LEU . 15.4 tmm? 64.98 93.86 0.06 Allowed 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.401 1.081 . . . . 0.0 110.539 179.532 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -71.35 99.92 2.06 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.837 -175.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 59.8 t -59.25 -35.7 59.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 124.039 0.936 . . . . 0.0 112.113 -174.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -56.51 -43.31 79.64 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.361 0.664 . . . . 0.0 111.601 -174.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.8 m -58.17 -43.8 87.65 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 123.989 0.806 . . . . 0.0 110.798 178.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.477 ' HA ' HG22 ' A' ' 15' ' ' ILE . 36.6 m-85 -74.24 -37.22 63.86 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.989 -176.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -57.59 -51.31 70.0 Favored 'General case' 0 C--O 1.244 0.802 0 C-N-CA 124.823 1.249 . . . . 0.0 110.497 -177.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.414 ' NZ ' ' HB2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -71.49 -42.45 68.03 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.276 -0.875 . . . . 0.0 111.568 -177.661 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.477 HG22 ' HA ' ' A' ' 12' ' ' TYR . 9.2 tt -67.68 -28.52 42.02 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 CA-C-N 118.474 0.579 . . . . 0.0 110.723 -177.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 42.1 mt -63.12 -47.41 82.93 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.299 0.64 . . . . 0.0 110.27 172.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.516 ' O ' ' HG3' ' A' ' 21' ' ' ARG . 48.2 mtm105 -62.57 -42.56 99.62 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 123.953 0.783 . . . . 0.0 111.229 176.186 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -59.74 -45.4 92.31 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 122.889 0.476 . . . . 0.0 110.198 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? -67.28 -42.11 84.34 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.776 -177.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.61 ' HB3' HG23 ' A' ' 69' ' ' ILE . 3.2 pt20 -71.13 -36.0 71.93 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-O 118.82 -0.609 . . . . 0.0 110.531 -174.621 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.617 ' HG2' ' HG2' ' A' ' 48' ' ' GLU . 53.7 mtp180 -75.67 -39.6 57.33 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 123.791 0.682 . . . . 0.0 111.934 -173.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -64.2 -40.02 95.2 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 123.459 0.475 . . . . 0.0 109.869 174.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.495 ' HB2' HD12 ' A' ' 66' ' ' LEU . 98.8 mt -72.78 -29.82 63.6 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.44 175.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.422 ' HB2' ' HA ' ' A' ' 21' ' ' ARG . 1.4 m-85 -65.5 -54.79 23.29 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.478 0.711 . . . . 0.0 109.498 178.64 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -66.35 -27.29 67.77 Favored 'General case' 0 N--CA 1.482 1.164 0 O-C-N 123.939 0.774 . . . . 0.0 110.758 -177.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -58.77 -52.76 64.35 Favored 'General case' 0 C--N 1.356 0.882 0 O-C-N 124.077 0.86 . . . . 0.0 110.695 173.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 3.2 pp -87.32 -11.79 48.43 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 31.0 m170 -92.66 17.29 10.48 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 123.866 0.866 . . . . 0.0 110.835 175.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.58 -27.27 25.61 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 124.001 0.92 . . . . 0.0 112.523 177.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.425 HG12 ' N ' ' A' ' 31' ' ' GLU . 0.2 OUTLIER -67.32 -40.61 85.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 123.601 0.761 . . . . 0.0 111.721 179.062 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.425 ' N ' HG12 ' A' ' 30' ' ' ILE . 12.5 pt-20 -106.07 -4.96 19.83 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.995 0.918 . . . . 0.0 111.418 -173.186 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -124.6 99.77 6.33 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.403 0.681 . . . . 0.0 109.468 -179.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -70.1 -31.69 69.38 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.47 0.708 . . . . 0.0 109.93 171.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -78.41 119.84 22.3 Favored 'General case' 0 C--O 1.244 0.811 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.403 -178.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -125.36 -16.62 5.85 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 123.382 0.673 . . . . 0.0 110.373 176.009 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 65.04 147.92 0.11 Allowed Pre-proline 0 CA--C 1.566 1.564 0 C-N-CA 125.979 1.711 . . . . 0.0 112.5 -175.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -57.99 -58.04 0.94 Allowed 'Trans proline' 0 C--N 1.383 2.389 0 C-N-CA 122.565 2.177 . . . . 0.0 111.704 171.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 80.2 mmt-85 -132.89 -84.56 0.47 Allowed 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.86 0.864 . . . . 0.0 109.336 174.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 37.6 p30 -72.96 157.88 87.99 Favored Pre-proline 0 N--CA 1.482 1.147 0 C-N-CA 123.879 0.872 . . . . 0.0 111.49 -173.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -65.56 -13.16 38.4 Favored 'Trans proline' 0 C--N 1.38 2.236 0 C-N-CA 122.411 2.074 . . . . 0.0 112.936 172.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 22.3 t70 77.2 -65.59 0.27 Allowed 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 125.966 1.706 . . . . 0.0 110.414 -176.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -78.61 -173.83 3.58 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.954 0.902 . . . . 0.0 111.039 178.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -62.54 -64.0 1.06 Allowed 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 123.853 0.861 . . . . 0.0 111.135 -178.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -174.77 136.91 0.43 Allowed 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.646 0.778 . . . . 0.0 110.392 -172.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 18.4 mmt180 -91.34 86.62 6.17 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 174.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.32 78.03 2.41 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-O 121.639 0.733 . . . . 0.0 110.81 -177.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 39.2 m -147.19 23.55 1.17 Allowed 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.858 1.263 . . . . 0.0 109.03 177.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.617 ' HG2' ' HG2' ' A' ' 21' ' ' ARG . 9.1 tp10 -84.85 148.64 26.18 Favored 'General case' 0 C--N 1.349 0.576 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.298 -171.433 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 42.6 ttp180 58.49 23.1 10.36 Favored 'General case' 0 CA--C 1.564 1.509 0 C-N-CA 124.833 1.253 . . . . 0.0 111.144 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.8 t -85.83 -9.42 57.05 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.152 0.981 . . . . 0.0 110.988 -176.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -96.26 99.97 11.64 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 179.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -90.58 68.27 6.59 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 121.972 0.892 . . . . 0.0 109.169 177.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -139.46 159.9 41.08 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 124.456 1.102 . . . . 0.0 109.284 174.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 93.6 t -78.12 -64.34 0.92 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 C-N-CA 123.36 0.664 . . . . 0.0 109.423 175.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.3 tp 57.17 117.75 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 125.655 1.582 . . . . 0.0 113.219 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -74.98 -21.09 59.36 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 124.139 0.976 . . . . 0.0 111.386 -175.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -71.09 -16.85 62.6 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.075 0.55 . . . . 0.0 112.341 177.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.497 ' HB2' ' NE2' ' A' ' 63' ' ' GLN . 18.1 mt -75.02 130.92 40.16 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 173.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -59.4 124.98 38.15 Favored Glycine 0 C--N 1.353 1.492 0 CA-C-O 118.808 -0.995 . . . . 0.0 111.521 177.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -62.49 -32.71 73.66 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 123.552 0.741 . . . . 0.0 112.22 -174.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.419 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 8.7 p -62.84 -39.04 83.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 123.251 0.62 . . . . 0.0 110.156 174.318 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -73.23 -43.11 40.3 Favored Glycine 0 C--N 1.348 1.198 0 O-C-N 123.686 0.616 . . . . 0.0 111.969 179.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.497 ' NE2' ' HB2' ' A' ' 58' ' ' LEU . 99.4 mt-30 -59.89 -45.34 92.84 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.028 0.931 . . . . 0.0 110.725 177.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -67.7 -40.57 84.31 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.121 0.968 . . . . 0.0 110.474 -178.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.432 ' O ' HG13 ' A' ' 69' ' ' ILE . 3.1 tp10 -65.15 -42.1 94.1 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.624 178.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.495 HD12 ' HB2' ' A' ' 23' ' ' LEU . 0.8 OUTLIER -70.31 -29.97 66.84 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.693 1.197 . . . . 0.0 111.35 179.927 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 41.9 ttt180 -69.4 -38.69 78.07 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 123.856 0.722 . . . . 0.0 109.665 175.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.85 -37.55 76.17 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.675 0.79 . . . . 0.0 111.038 177.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.61 HG23 ' HB3' ' A' ' 20' ' ' GLN . 98.7 mt -68.95 -40.29 80.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 123.61 0.764 . . . . 0.0 110.016 175.303 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -66.74 -39.21 87.86 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.7 0.8 . . . . 0.0 110.17 -178.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.58 -41.85 92.42 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.632 0.773 . . . . 0.0 110.493 176.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.436 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -65.28 -45.82 82.9 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.874 0.869 . . . . 0.0 111.186 179.463 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.484 HD22 HD13 ' A' ' 76' ' ' ILE . 80.5 mt -65.53 -31.99 73.34 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.161 0.984 . . . . 0.0 111.222 177.278 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.6 -34.07 69.56 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.479 0.712 . . . . 0.0 110.951 177.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -65.38 -36.19 83.22 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.006 0.522 . . . . 0.0 110.213 172.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.484 HD13 HD22 ' A' ' 73' ' ' LEU . 55.8 mt -66.68 -43.7 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 177.424 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.83 -30.44 71.49 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.533 1.133 . . . . 0.0 111.539 175.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.9 t -85.07 -17.27 37.92 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.833 0.853 . . . . 0.0 111.115 177.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 82.15 13.29 79.37 Favored Glycine 0 C--N 1.347 1.188 0 C-N-CA 123.412 0.53 . . . . 0.0 113.549 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 12.4 t -125.14 33.39 5.18 Favored 'General case' 0 CA--C 1.556 1.18 0 C-N-CA 124.176 0.99 . . . . 0.0 110.718 -177.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -62.84 144.32 56.72 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 121.91 -0.494 . . . . 0.0 110.087 165.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.21 31.06 32.34 Favored Glycine 0 C--N 1.341 0.848 0 O-C-N 123.965 0.791 . . . . 0.0 111.359 -171.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.7 m -130.46 114.55 15.67 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.717 0.807 . . . . 0.0 110.203 175.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 44.1 t -61.13 106.16 0.57 Allowed 'General case' 0 C--N 1.351 0.667 0 C-N-CA 124.101 0.96 . . . . 0.0 109.131 170.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 26.8 m -59.09 -31.01 44.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 O-C-N 124.236 0.96 . . . . 0.0 110.995 177.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 36.0 tttm -80.22 -7.56 59.04 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.084 0.953 . . . . 0.0 111.624 -176.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 62.8 m -119.83 -24.25 6.2 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 124.023 0.929 . . . . 0.0 111.91 174.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 65.04 27.8 72.74 Favored Glycine 0 CA--C 1.537 1.461 0 O-C-N 123.423 0.452 . . . . 0.0 112.103 -165.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -134.42 172.94 12.2 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.747 0.819 . . . . 0.0 110.133 -171.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.54 151.71 44.77 Favored 'General case' 0 CA--C 1.573 1.838 0 C-N-CA 124.377 1.071 . . . . 0.0 111.468 -172.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 8.7 mm -99.21 152.09 4.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 C-N-CA 125.237 1.415 . . . . 0.0 109.807 174.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.1 m -72.33 142.76 48.82 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 122.985 0.514 . . . . 0.0 109.737 173.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 46.2 tt0 -66.47 -32.14 73.32 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.866 0.466 . . . . 0.0 110.211 175.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.436 ' HA ' ' HE3' ' A' ' 97' ' ' LYS . 35.7 m-20 -66.83 -34.95 78.94 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.737 0.815 . . . . 0.0 111.393 175.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -60.77 -45.15 95.46 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 123.948 0.78 . . . . 0.0 110.297 173.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.468 HD11 ' HG3' ' A' ' 7' ' ' MET . 98.3 mt -81.64 -27.25 34.21 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 -173.354 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.436 ' HE3' ' HA ' ' A' ' 94' ' ' ASP . 16.9 ptpt -73.69 -31.39 63.41 Favored 'General case' 0 N--CA 1.483 1.207 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 177.384 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.44 -43.36 19.01 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.769 0.828 . . . . 0.0 110.838 176.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.2 p -150.18 94.88 3.67 Favored Pre-proline 0 CA--C 1.556 1.179 0 C-N-CA 124.477 1.111 . . . . 0.0 109.325 -178.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -76.05 -10.14 19.47 Favored 'Trans proline' 0 C--N 1.379 2.173 0 C-N-CA 122.574 2.183 . . . . 0.0 112.967 177.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 15.3 p90 -101.8 48.91 0.87 Allowed 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.835 0.854 . . . . 0.0 110.545 -176.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 10.1 t -129.77 116.22 18.13 Favored Pre-proline 0 CA--C 1.55 0.968 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.383 171.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -76.16 -0.06 9.91 Favored 'Trans proline' 0 C--N 1.372 1.792 0 C-N-CA 122.348 2.032 . . . . 0.0 111.933 170.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.403 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 9.6 m-85 -115.56 146.36 41.81 Favored 'General case' 0 C--N 1.351 0.668 0 C-N-CA 123.974 0.909 . . . . 0.0 109.39 -176.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.421 ' SG ' ' HB2' ' A' ' 107' ' ' GLU . 23.4 p -77.11 162.87 27.12 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 172.56 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -59.87 -29.95 68.66 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 118.21 0.459 . . . . 0.0 111.881 -174.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.421 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 33.7 mt-10 -55.55 -52.3 64.18 Favored 'General case' 0 N--CA 1.481 1.101 0 O-C-N 123.986 0.804 . . . . 0.0 110.586 171.437 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.403 ' HB2' ' HB3' ' A' ' 104' ' ' PHE . 93.2 m -68.53 -39.59 81.1 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.278 178.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -63.43 -36.63 84.36 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.774 0.83 . . . . 0.0 111.115 -177.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -81.24 -22.36 38.79 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.71 0.804 . . . . 0.0 110.865 177.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -88.0 -7.75 56.61 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.838 0.855 . . . . 0.0 112.367 178.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 84.0 mt . . . . . 0 N--CA 1.481 1.115 0 CA-C-O 118.712 -0.661 . . . . 0.0 110.42 176.965 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.2 tm? . . . . . 0 N--CA 1.488 1.452 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -172.59 129.49 0.54 Allowed 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.183 0.993 . . . . 0.0 109.509 177.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 177.8 67.25 0.06 OUTLIER Glycine 0 C--N 1.339 0.741 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -156.35 133.9 3.85 Favored Glycine 0 C--N 1.346 1.093 0 N-CA-C 112.04 -0.424 . . . . 0.0 112.04 -179.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -124.43 -62.27 1.27 Allowed 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.175 0.99 . . . . 0.0 110.096 -178.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.6 t -131.9 -61.23 0.89 Allowed 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.251 0.621 . . . . 0.0 109.738 -176.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 50.6 ttm -91.55 146.89 23.42 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 176.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -74.94 77.57 2.17 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-O 121.754 0.788 . . . . 0.0 110.329 177.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 49.2 t -77.58 -26.49 15.17 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-N 114.878 -1.056 . . . . 0.0 110.605 -177.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -67.06 -33.4 75.44 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.31 0.644 . . . . 0.0 110.759 178.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.8 m -61.94 -43.37 98.98 Favored 'General case' 0 C--O 1.243 0.732 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.378 172.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.41 ' HA ' HG21 ' A' ' 15' ' ' ILE . 22.6 m-85 -68.61 -37.97 80.19 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 114.941 -1.027 . . . . 0.0 110.585 177.414 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.464 ' HG2' HG21 ' A' ' 76' ' ' ILE . 2.5 tm-20 -56.47 -55.39 34.27 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 125.218 1.407 . . . . 0.0 110.302 -175.21 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.1 -45.03 78.46 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.79 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.45 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 12.5 tt -65.22 -31.63 54.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 CA-C-N 118.099 0.409 . . . . 0.0 110.847 -174.242 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.526 ' HB3' HG21 ' A' ' 69' ' ' ILE . 60.1 mt -64.57 -44.38 90.89 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.516 0.726 . . . . 0.0 110.449 174.577 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 53.1 mtt180 -63.44 -39.77 95.37 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 123.864 0.728 . . . . 0.0 111.357 177.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -65.93 -44.21 85.78 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.899 0.479 . . . . 0.0 110.473 -177.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.45 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -66.38 -43.58 85.5 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.893 178.276 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.611 ' HB3' HG23 ' A' ' 69' ' ' ILE . 2.0 pt20 -70.14 -29.41 66.32 Favored 'General case' 0 C--O 1.207 -1.171 0 CA-C-O 118.608 -0.711 . . . . 0.0 110.707 -177.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 87.5 mtt180 -74.93 -44.58 47.8 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.704 0.802 . . . . 0.0 112.114 -177.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -62.62 -43.37 98.99 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-O 121.371 0.605 . . . . 0.0 109.703 177.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.584 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 86.6 mt -70.59 -33.84 71.52 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 114.918 -1.037 . . . . 0.0 110.417 176.469 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.479 ' O ' ' HB2' ' A' ' 28' ' ' HIS . 0.2 OUTLIER -59.93 -56.62 19.42 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.285 0.634 . . . . 0.0 109.586 -177.917 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 20.4 ptt180 -64.62 -30.36 71.38 Favored 'General case' 0 N--CA 1.48 1.067 0 O-C-N 124.044 0.84 . . . . 0.0 110.895 -177.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -58.86 -57.75 11.68 Favored 'General case' 0 C--N 1.36 1.035 0 O-C-N 123.614 0.571 . . . . 0.0 111.359 175.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.601 ' HB2' ' HA ' ' A' ' 58' ' ' LEU . 2.2 pp -84.04 -25.32 29.96 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -174.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.479 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 3.5 m-70 -89.13 48.1 1.58 Allowed 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 123.845 0.858 . . . . 0.0 109.571 177.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 9.7 ptpt -64.93 -23.75 67.32 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 125.01 1.324 . . . . 0.0 111.765 178.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -62.75 -36.32 74.84 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.096 0 C-N-CA 124.113 0.965 . . . . 0.0 112.246 178.402 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -101.67 -26.78 13.38 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.023 0.529 . . . . 0.0 110.514 178.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -125.17 91.92 3.53 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.078 0.951 . . . . 0.0 110.298 -173.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -70.33 134.26 47.75 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 169.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -66.0 85.07 0.08 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.564 0.746 . . . . 0.0 110.326 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -101.15 -16.65 16.97 Favored 'General case' 0 C--O 1.241 0.652 0 C-N-CA 123.938 0.895 . . . . 0.0 110.215 179.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -73.99 138.27 76.12 Favored Pre-proline 0 CA--C 1.548 0.9 0 CA-C-N 115.309 -0.859 . . . . 0.0 109.586 178.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -61.2 160.55 26.21 Favored 'Trans proline' 0 C--N 1.378 2.12 0 C-N-CA 122.986 2.457 . . . . 0.0 112.484 175.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 15.3 mmm180 -72.61 -18.69 61.57 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.434 0.694 . . . . 0.0 111.252 175.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -69.66 153.22 95.83 Favored Pre-proline 0 CA--C 1.551 1.015 0 C-N-CA 123.495 0.718 . . . . 0.0 109.636 168.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -67.17 78.22 0.43 Allowed 'Trans proline' 0 C--N 1.377 2.033 0 C-N-CA 122.746 2.298 . . . . 0.0 111.874 175.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -110.28 35.62 3.36 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 124.324 1.049 . . . . 0.0 108.447 -177.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -75.37 80.07 2.44 Favored 'General case' 0 C--N 1.351 0.633 0 CA-C-N 114.61 -1.177 . . . . 0.0 109.148 178.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -82.44 -51.58 7.7 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-N 114.807 -1.088 . . . . 0.0 109.966 -178.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -164.34 123.43 1.9 Allowed 'General case' 0 C--O 1.239 0.537 0 CA-C-N 114.832 -1.076 . . . . 0.0 109.568 175.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 10.2 tpt180 -137.23 101.25 4.48 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 106.422 -1.695 . . . . 0.0 106.422 175.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.33 -31.25 63.56 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 124.37 1.068 . . . . 0.0 113.839 -166.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 78.3 p 48.04 36.92 6.94 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 125.156 1.382 . . . . 0.0 111.341 -172.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -68.75 -22.52 64.3 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 114.372 -1.285 . . . . 0.0 110.793 -176.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 52.6 mtp180 73.87 161.25 0.24 Allowed 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 125.581 1.553 . . . . 0.0 112.513 177.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 34.7 t -135.58 -112.25 0.2 Allowed 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 175.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -76.98 118.59 19.71 Favored 'General case' 0 C--N 1.354 0.765 0 CA-C-N 119.052 0.842 . . . . 0.0 109.249 171.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -125.25 86.69 2.58 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.584 0.707 . . . . 0.0 109.522 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -119.11 -170.39 1.91 Allowed 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.47 174.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 90.6 t -57.78 -59.33 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 123.443 0.697 . . . . 0.0 110.043 176.034 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.618 ' HB2' ' HG ' ' A' ' 58' ' ' LEU . 95.5 mt 58.31 124.51 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 125.793 1.637 . . . . 0.0 114.199 172.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -65.09 -20.18 66.35 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.334 0.654 . . . . 0.0 110.704 173.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -64.21 -30.36 71.42 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.022 1.329 . . . . 0.0 111.155 176.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.618 ' HG ' ' HB2' ' A' ' 55' ' ' LEU . 9.2 mt -81.3 141.46 34.04 Favored 'General case' 0 C--N 1.35 0.592 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 179.164 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -81.08 142.76 23.5 Favored Glycine 0 C--N 1.349 1.273 0 CA-C-O 119.292 -0.727 . . . . 0.0 112.039 177.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -55.41 -54.74 39.94 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 124.365 1.066 . . . . 0.0 112.014 -174.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.4 p -53.29 -41.24 42.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 123.701 0.8 . . . . 0.0 111.492 178.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.405 ' HA3' HD21 ' A' ' 27' ' ' LEU . . . -67.89 -41.64 87.68 Favored Glycine 0 C--O 1.215 -1.053 0 O-C-N 123.767 0.667 . . . . 0.0 113.049 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -66.75 -46.34 75.7 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.205 0.602 . . . . 0.0 111.01 -178.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -63.27 -37.3 86.69 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.837 0.855 . . . . 0.0 110.884 178.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -71.27 -45.03 64.1 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.141 -179.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.7 mp -62.27 -33.23 74.22 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.562 1.145 . . . . 0.0 110.932 176.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 73.3 ttt180 -67.95 -43.35 79.28 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.672 0.789 . . . . 0.0 110.339 176.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -67.62 -38.36 83.8 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.755 0.822 . . . . 0.0 111.273 179.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.611 HG23 ' HB3' ' A' ' 20' ' ' GLN . 96.6 mt -69.61 -41.67 80.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.858 0.863 . . . . 0.0 110.075 177.011 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -63.73 -38.56 91.55 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.673 0.789 . . . . 0.0 110.76 178.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.495 ' HB2' HH12 ' A' ' 75' ' ' ARG . . . -63.95 -42.91 97.17 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.867 0.867 . . . . 0.0 110.687 177.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.438 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -66.0 -51.32 59.41 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 114.913 -1.039 . . . . 0.0 111.102 179.1 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.508 HD22 HD13 ' A' ' 76' ' ' ILE . 82.1 mt -62.59 -36.72 83.61 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.427 1.091 . . . . 0.0 111.886 -179.214 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.81 -43.9 97.59 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.469 0.708 . . . . 0.0 110.244 175.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.495 HH12 ' HB2' ' A' ' 71' ' ' ALA . 80.7 mtt85 -73.51 -26.3 60.82 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 115.244 -0.889 . . . . 0.0 112.267 179.43 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.508 HD13 HD22 ' A' ' 73' ' ' LEU . 80.6 mt -69.76 -46.59 74.05 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 CA-C-N 118.473 0.579 . . . . 0.0 109.536 174.615 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.74 -36.59 83.52 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.867 178.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 30.2 t -81.09 -17.77 48.86 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 123.729 0.812 . . . . 0.0 111.433 177.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 81.6 10.3 84.55 Favored Glycine 0 C--N 1.35 1.35 0 C-N-CA 123.198 0.428 . . . . 0.0 113.893 178.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.8 t -106.89 21.33 17.7 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 124.415 1.086 . . . . 0.0 110.261 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -61.46 142.79 56.76 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 122.578 0.351 . . . . 0.0 110.335 173.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.512 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 82.5 20.72 61.49 Favored Glycine 0 C--O 1.218 -0.864 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.521 -175.234 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 26.4 m -113.11 110.43 20.43 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 117.524 0.662 . . . . 0.0 109.825 174.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 49.2 t -73.45 93.91 2.03 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 124.459 1.104 . . . . 0.0 109.857 172.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 34.1 m -63.85 -22.25 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.298 1.039 . . . . 0.0 112.751 -176.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.524 ' HD3' ' HB3' ' A' ' 108' ' ' CYS . 56.4 tttm -69.83 -24.44 63.46 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 122.675 0.39 . . . . 0.0 111.585 -178.288 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 29.0 p -127.59 11.16 6.74 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 122.626 0.37 . . . . 0.0 110.879 173.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 56.63 27.11 54.38 Favored Glycine 0 C--N 1.36 1.9 0 C-N-CA 123.869 0.747 . . . . 0.0 114.932 176.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -135.96 -176.7 4.39 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.983 0.913 . . . . 0.0 110.228 -174.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.512 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 12.8 tpp180 -68.77 152.29 45.52 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 124.585 1.154 . . . . 0.0 112.664 -172.041 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 3.1 mm -92.16 145.36 7.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 165.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 61.8 m -66.99 145.25 55.6 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 122.252 0.221 . . . . 0.0 110.561 176.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -61.47 -39.94 92.72 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.254 0.622 . . . . 0.0 110.42 177.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.425 ' HA ' ' HG2' ' A' ' 97' ' ' LYS . 16.1 m-20 -65.2 -35.69 81.84 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.863 0.865 . . . . 0.0 111.303 178.266 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -63.87 -44.12 94.03 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.07 176.133 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 96.3 mt -75.45 -36.49 60.7 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.364 0.666 . . . . 0.0 112.502 -176.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.425 ' HG2' ' HA ' ' A' ' 94' ' ' ASP . 16.6 ptpt -73.25 -28.81 62.35 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 120.528 0.204 . . . . 0.0 110.713 -176.403 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -80.48 -48.66 12.49 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 123.923 0.765 . . . . 0.0 110.299 174.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.1 p -144.72 99.96 4.72 Favored Pre-proline 0 CA--C 1.555 1.161 0 C-N-CA 124.231 1.012 . . . . 0.0 109.299 -178.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -78.47 -5.57 14.97 Favored 'Trans proline' 0 C--N 1.373 1.836 0 C-N-CA 122.531 2.154 . . . . 0.0 113.021 178.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 18.9 p90 -105.34 54.37 0.7 Allowed 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.718 0.807 . . . . 0.0 110.032 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.8 t -135.14 101.57 11.24 Favored Pre-proline 0 CA--C 1.554 1.099 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.639 172.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -59.8 -18.79 50.91 Favored 'Trans proline' 0 C--N 1.382 2.295 0 C-N-CA 123.245 2.63 . . . . 0.0 113.096 172.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -104.48 126.09 51.25 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.841 0.857 . . . . 0.0 109.859 -177.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 16.5 p -69.39 158.88 34.25 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 171.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 62.9 tp60 -48.13 -39.84 21.78 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 114.09 1.144 . . . . 0.0 114.09 -169.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -69.37 -34.0 73.92 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-N 117.943 0.338 . . . . 0.0 111.849 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.524 ' HB3' ' HD3' ' A' ' 86' ' ' LYS . 99.5 m -72.33 -38.85 68.55 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.331 0.652 . . . . 0.0 111.396 174.19 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.58 -33.25 75.47 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.826 0.85 . . . . 0.0 111.017 176.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.99 -31.38 58.95 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.016 0.926 . . . . 0.0 111.047 176.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -80.2 -10.64 59.77 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.726 0.81 . . . . 0.0 112.276 -178.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 95.4 mt . . . . . 0 C--O 1.252 1.201 0 CA-C-O 118.693 -0.67 . . . . 0.0 110.227 177.181 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.553 ' H1 ' HD13 ' A' ' 1' ' ' LEU . 5.4 mp . . . . . 0 N--CA 1.481 1.118 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 62.07 98.41 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 124.695 1.198 . . . . 0.0 110.682 -178.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -67.92 81.68 0.18 Allowed Glycine 0 C--N 1.351 1.38 0 CA-C-N 116.303 -0.408 . . . . 0.0 112.121 177.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -78.46 73.75 2.18 Favored Glycine 0 C--N 1.35 1.349 0 C-N-CA 123.377 0.513 . . . . 0.0 112.669 -177.05 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -67.69 -34.23 76.49 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.63 0.772 . . . . 0.0 110.349 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 32.1 t -62.99 -53.11 59.04 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.625 1.17 . . . . 0.0 110.985 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 39.0 ttp -85.63 4.44 36.36 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.294 0.637 . . . . 0.0 110.965 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.0 m120 63.18 28.1 15.81 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 124.631 1.172 . . . . 0.0 111.817 173.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 86.2 t -50.98 -41.21 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.607 1.163 . . . . 0.0 112.106 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -64.21 -37.4 87.35 Favored 'General case' 0 N--CA 1.484 1.27 0 O-C-N 123.722 0.639 . . . . 0.0 111.499 -176.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 17.4 m -63.0 -42.5 99.86 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.556 0.742 . . . . 0.0 110.042 176.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.48 ' HA ' HG22 ' A' ' 15' ' ' ILE . 28.3 m-85 -72.25 -33.79 67.77 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-N 114.611 -1.177 . . . . 0.0 110.735 179.131 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -59.73 -52.53 65.11 Favored 'General case' 0 C--O 1.246 0.875 0 C-N-CA 125.082 1.353 . . . . 0.0 110.268 -175.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.508 ' HZ1' ' HB2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -67.05 -48.49 68.14 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.995 179.518 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.48 HG22 ' HA ' ' A' ' 12' ' ' TYR . 13.3 tt -64.66 -29.65 48.0 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.35 0 CA-C-N 118.197 0.453 . . . . 0.0 110.688 -173.031 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.52 ' HB3' HG21 ' A' ' 69' ' ' ILE . 45.5 mt -62.34 -50.53 71.23 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.205 0.602 . . . . 0.0 110.248 172.27 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 52.3 mtm180 -64.23 -28.52 69.79 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.488 -0.778 . . . . 0.0 112.441 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -80.98 -33.34 33.85 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.302 0.641 . . . . 0.0 110.351 -177.302 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.447 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -69.46 -42.6 74.67 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.021 172.698 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.613 ' HB3' HG23 ' A' ' 69' ' ' ILE . 1.4 pt20 -71.37 -22.59 61.87 Favored 'General case' 0 C--O 1.208 -1.083 0 CA-C-O 119.349 -0.358 . . . . 0.0 110.324 179.554 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 32.6 mtt180 -62.84 -60.01 4.07 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.188 0.595 . . . . 0.0 110.52 173.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -60.98 -34.22 74.44 Favored 'General case' 0 N--CA 1.48 1.051 0 O-C-N 123.933 0.771 . . . . 0.0 110.833 -178.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 86.5 mt -69.08 -51.87 34.22 Favored 'General case' 0 C--N 1.352 0.707 0 C-N-CA 122.984 0.514 . . . . 0.0 111.336 176.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -56.19 -39.6 72.66 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 123.552 0.741 . . . . 0.0 111.416 -173.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 18.1 ptt180 -78.02 -33.36 51.16 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 122.428 0.291 . . . . 0.0 111.2 178.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 25.2 ttm180 -65.1 -41.42 94.95 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.517 0.727 . . . . 0.0 111.361 177.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.3 pp -94.02 -28.58 15.68 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.799 0.44 . . . . 0.0 111.193 -172.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -91.35 33.4 0.99 Allowed 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 167.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 18.8 pttp -46.59 -42.73 16.47 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 125.933 1.693 . . . . 0.0 112.465 169.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -62.48 -31.09 50.73 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.911 0 C-N-CA 124.34 1.056 . . . . 0.0 111.942 179.621 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -93.8 -21.04 19.54 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.653 0.781 . . . . 0.0 110.822 178.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -83.45 170.18 14.74 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.737 0.815 . . . . 0.0 110.493 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -84.43 30.53 0.54 Allowed 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 124.013 0.925 . . . . 0.0 111.862 -176.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 14.9 t80 60.44 95.91 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 124.895 1.278 . . . . 0.0 109.807 -174.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -61.18 -66.44 0.53 Allowed 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.467 0.707 . . . . 0.0 112.269 -168.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 60.92 108.5 0.03 OUTLIER Pre-proline 0 N--CA 1.483 1.186 0 C-N-CA 125.003 1.321 . . . . 0.0 110.921 -168.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -72.41 79.48 1.8 Allowed 'Trans proline' 0 C--N 1.377 2.035 0 C-N-CA 122.544 2.163 . . . . 0.0 111.304 179.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 25.3 mtp180 -63.36 -36.67 84.47 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.974 0.91 . . . . 0.0 110.06 179.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -143.83 138.58 15.29 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 124.915 1.286 . . . . 0.0 108.868 177.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -64.9 -24.87 60.38 Favored 'Trans proline' 0 C--N 1.38 2.219 0 C-N-CA 122.666 2.244 . . . . 0.0 111.586 174.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -86.58 133.81 33.69 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.348 1.059 . . . . 0.0 110.081 177.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.52 172.67 12.99 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.377 0.671 . . . . 0.0 110.792 171.744 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -90.12 75.17 7.09 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 173.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 26.8 t70 68.55 29.81 5.41 Favored 'General case' 0 CA--C 1.557 1.228 0 CA-C-N 114.23 -1.35 . . . . 0.0 110.269 178.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 35.6 ttp180 69.61 126.92 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 125.339 1.456 . . . . 0.0 111.605 -176.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -145.88 -176.43 5.14 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.085 0.554 . . . . 0.0 111.257 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 40.9 m 78.21 149.67 0.1 Allowed 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 126.279 1.831 . . . . 0.0 112.858 175.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.506 ' HG3' ' HD2' ' A' ' 49' ' ' ARG . 13.0 pt-20 -158.47 -131.2 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.051 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 173.414 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.506 ' HD2' ' HG3' ' A' ' 48' ' ' GLU . 8.3 mpt_? 66.29 80.48 0.22 Allowed 'General case' 0 C--N 1.361 1.084 0 C-N-CA 124.173 0.989 . . . . 0.0 110.057 179.003 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.6 p -83.75 70.83 10.42 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 114.848 -1.069 . . . . 0.0 109.931 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.533 ' HB3' ' HG2' ' A' ' 53' ' ' GLU . 2.1 m-20 -69.29 124.11 22.96 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 114.987 -1.006 . . . . 0.0 109.849 -178.804 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -107.45 38.6 2.1 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.607 0.763 . . . . 0.0 109.754 178.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.533 ' HG2' ' HB3' ' A' ' 51' ' ' ASN . 12.5 mm-40 -65.82 150.49 48.48 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.266 -0.879 . . . . 0.0 112.089 -175.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 38.6 t -67.51 -26.44 35.62 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 C-N-CA 124.218 1.007 . . . . 0.0 110.594 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 32.1 tp -58.75 111.67 1.36 Allowed 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 123.407 0.683 . . . . 0.0 110.77 178.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -98.34 48.39 0.99 Allowed 'General case' 0 CA--C 1.554 1.103 0 CA-C-O 122.452 1.12 . . . . 0.0 109.121 -175.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -93.3 26.03 3.1 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 124.964 1.306 . . . . 0.0 109.871 173.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.8 mt -103.26 147.26 27.27 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.18 0.992 . . . . 0.0 109.035 -170.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -64.65 145.01 49.11 Favored Glycine 0 N--CA 1.477 1.387 0 CA-C-O 119.592 -0.56 . . . . 0.0 113.27 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -64.07 -60.35 3.34 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.699 0.8 . . . . 0.0 111.719 -174.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.2 t -58.89 -32.34 47.03 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 123.881 0.872 . . . . 0.0 110.2 177.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.509 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -59.66 -51.77 57.02 Favored Glycine 0 C--N 1.353 1.511 0 O-C-N 124.051 0.844 . . . . 0.0 112.624 174.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -72.27 -36.66 69.07 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 124.098 0.959 . . . . 0.0 112.339 -175.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -73.28 -38.77 65.79 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.413 0.685 . . . . 0.0 110.369 -176.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -71.22 -37.05 72.05 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.627 174.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.509 ' HB2' ' O ' ' A' ' 62' ' ' GLY . 6.2 tp -58.62 -45.95 88.13 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 124.606 1.162 . . . . 0.0 109.568 177.209 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 47.4 ttt180 -64.84 -38.84 92.31 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.481 1.112 . . . . 0.0 110.5 -178.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.52 -36.64 83.2 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.914 177.015 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.613 HG23 ' HB3' ' A' ' 20' ' ' GLN . 95.0 mt -69.86 -49.79 54.24 Favored 'Isoleucine or valine' 0 C--N 1.356 0.86 0 C-N-CA 123.594 0.758 . . . . 0.0 110.83 178.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 52.6 m-20 -65.18 -35.64 81.71 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.753 0.821 . . . . 0.0 111.151 -177.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.426 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -64.88 -45.5 85.73 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.312 0.645 . . . . 0.0 109.96 175.028 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.412 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -67.15 -34.91 78.58 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.993 0.917 . . . . 0.0 111.709 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.461 HD23 HD12 ' A' ' 76' ' ' ILE . 71.9 mt -72.75 -32.33 65.59 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.857 0.863 . . . . 0.0 110.821 177.099 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.57 -27.64 63.29 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.875 0.87 . . . . 0.0 110.785 174.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.426 ' HG2' ' O ' ' A' ' 71' ' ' ALA . 5.7 mmp_? -69.06 -42.48 76.2 Favored 'General case' 0 C--N 1.353 0.75 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 172.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.461 HD12 HD23 ' A' ' 73' ' ' LEU . 71.1 mt -64.68 -41.36 92.0 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 C-N-CA 123.206 0.602 . . . . 0.0 110.367 177.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -59.37 -38.81 81.39 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.027 0.931 . . . . 0.0 111.292 178.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.532 ' HB3' HG23 ' A' ' 80' ' ' THR . 35.5 t -87.05 -13.9 43.04 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 115.027 -0.988 . . . . 0.0 111.226 178.279 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 78.75 8.15 87.88 Favored Glycine 0 C--N 1.348 1.25 0 C-N-CA 123.177 0.417 . . . . 0.0 113.441 -176.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.532 HG23 ' HB3' ' A' ' 78' ' ' SER . 13.5 t -101.4 24.58 9.41 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.708 1.203 . . . . 0.0 110.065 -178.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -61.89 152.87 30.66 Favored 'General case' 0 C--N 1.35 0.595 0 C-N-CA 123.222 0.609 . . . . 0.0 110.351 170.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.521 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 70.39 21.39 77.42 Favored Glycine 0 C--N 1.344 0.984 0 CA-C-N 115.639 -0.71 . . . . 0.0 112.476 -176.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 30.9 m -118.23 113.89 22.19 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.471 0.709 . . . . 0.0 109.69 178.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 52.7 t -72.93 90.12 1.45 Allowed 'General case' 0 C--O 1.238 0.472 0 C-N-CA 123.438 0.695 . . . . 0.0 109.517 171.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 29.5 m -61.22 -23.03 28.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 124.411 1.084 . . . . 0.0 112.756 -176.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.409 ' HD3' ' HB3' ' A' ' 108' ' ' CYS . 54.5 tttm -64.71 -27.2 68.75 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.305 0.642 . . . . 0.0 111.588 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.451 ' SG ' ' HB2' ' A' ' 89' ' ' LYS . 30.7 p -136.14 4.12 2.94 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 112.038 0.384 . . . . 0.0 112.038 -179.252 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 63.06 30.89 78.87 Favored Glycine 0 C--N 1.349 1.264 0 O-C-N 123.128 0.267 . . . . 0.0 113.723 -178.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.451 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 11.5 mmmm -106.88 172.08 7.01 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.806 0.842 . . . . 0.0 110.462 -179.568 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.521 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 15.2 tpp180 -90.92 128.4 36.76 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.126 0.97 . . . . 0.0 109.651 177.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 9.2 mm -64.91 142.4 16.97 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 171.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 19.6 m -74.26 150.72 40.11 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 122.847 0.459 . . . . 0.0 109.774 177.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -61.96 -37.14 83.64 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 122.919 0.488 . . . . 0.0 110.287 175.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -62.17 -45.87 91.46 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 124.115 0.966 . . . . 0.0 110.755 176.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.423 ' HG3' HG22 ' A' ' 102' ' ' THR . 28.3 tpt180 -60.85 -40.62 93.57 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.405 175.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 82.0 mt -69.75 -38.45 76.81 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.508 0.723 . . . . 0.0 112.184 -178.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -79.18 -30.95 43.69 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 122.372 0.269 . . . . 0.0 110.42 -174.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -80.06 -39.28 30.08 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.806 0.842 . . . . 0.0 110.641 177.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.5 p -148.48 92.3 4.54 Favored Pre-proline 0 CA--C 1.556 1.196 0 C-N-CA 124.33 1.052 . . . . 0.0 109.49 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.06 -17.3 31.82 Favored 'Trans proline' 0 C--N 1.378 2.086 0 C-N-CA 122.404 2.069 . . . . 0.0 112.346 175.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 10.7 p90 -94.6 62.71 2.82 Favored 'General case' 0 C--N 1.348 0.525 0 C-N-CA 124.333 1.053 . . . . 0.0 109.092 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.423 HG22 ' HG3' ' A' ' 95' ' ' ARG . 12.4 t -137.54 117.08 10.19 Favored Pre-proline 0 CA--C 1.553 1.089 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.511 178.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -81.23 -7.29 12.98 Favored 'Trans proline' 0 C--N 1.368 1.568 0 C-N-CA 122.259 1.972 . . . . 0.0 111.877 169.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -116.97 143.97 45.11 Favored 'General case' 0 C--N 1.356 0.858 0 C-N-CA 123.465 0.706 . . . . 0.0 110.162 -175.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.4 ' SG ' ' HB2' ' A' ' 107' ' ' GLU . 30.6 p -80.89 164.25 22.77 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 174.697 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -51.31 -37.77 49.34 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.791 0.837 . . . . 0.0 111.705 -178.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.4 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 37.5 mt-10 -54.88 -53.59 53.48 Favored 'General case' 0 CA--C 1.55 0.957 0 O-C-N 124.378 1.049 . . . . 0.0 110.74 175.533 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.409 ' HB3' ' HD3' ' A' ' 86' ' ' LYS . 87.8 m -71.35 -34.24 70.33 Favored 'General case' 0 N--CA 1.482 1.141 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.68 -176.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -63.28 -38.85 92.75 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.718 0.807 . . . . 0.0 110.546 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -77.34 -25.94 51.57 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.802 0.841 . . . . 0.0 111.108 176.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -106.17 22.81 15.09 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 123.898 0.879 . . . . 0.0 111.976 -176.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 73.0 mt . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 119.028 -0.511 . . . . 0.0 110.004 173.04 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.473 ' H3 ' HD11 ' A' ' 1' ' ' LEU . 4.5 mp . . . . . 0 N--CA 1.493 1.68 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 57.43 86.78 0.07 Allowed 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.86 1.264 . . . . 0.0 112.949 171.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -67.73 -44.99 78.93 Favored Glycine 0 C--N 1.347 1.15 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.763 179.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -107.3 85.99 0.44 Allowed Glycine 0 C--N 1.338 0.664 0 N-CA-C 111.344 -0.702 . . . . 0.0 111.344 178.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -156.49 -71.65 0.1 Allowed 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.286 0.634 . . . . 0.0 110.956 178.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.639 ' HB2' ' HB2' ' A' ' 93' ' ' GLU . 59.6 p -100.98 62.67 0.99 Allowed 'General case' 0 C--O 1.245 0.86 0 C-N-CA 123.743 0.817 . . . . 0.0 110.963 -171.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 39.1 ttm -167.68 96.16 0.45 Allowed 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.188 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -89.32 84.09 6.45 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 171.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 90.6 t -54.92 -41.81 60.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 CA-C-N 114.675 -1.148 . . . . 0.0 111.966 -172.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -61.07 -39.22 89.07 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.708 0.803 . . . . 0.0 111.732 -177.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 17.7 m -62.5 -42.2 99.34 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.379 0.672 . . . . 0.0 110.013 177.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.463 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 26.4 m-85 -71.6 -33.02 68.64 Favored 'General case' 0 C--O 1.213 -0.844 0 CA-C-N 114.558 -1.201 . . . . 0.0 110.788 179.066 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -67.42 -53.13 31.75 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 124.047 0.939 . . . . 0.0 110.523 -175.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -63.13 -43.32 98.69 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.416 -179.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.488 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 13.7 tt -65.24 -33.4 63.42 Favored 'Isoleucine or valine' 0 C--N 1.363 1.16 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 -177.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.533 ' HB3' HG21 ' A' ' 69' ' ' ILE . 61.2 mt -67.17 -36.82 82.61 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.127 0.571 . . . . 0.0 111.402 177.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 19.8 mtm180 -63.79 -41.49 97.92 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 123.279 0.362 . . . . 0.0 110.856 176.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -69.78 -40.25 76.15 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.028 0.531 . . . . 0.0 111.468 -179.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.488 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -63.99 -50.34 68.92 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.442 0.697 . . . . 0.0 110.276 178.621 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.572 ' HB3' HG23 ' A' ' 69' ' ' ILE . 2.9 pt20 -64.71 -31.56 72.83 Favored 'General case' 0 C--O 1.213 -0.864 0 CA-C-O 119.248 -0.406 . . . . 0.0 110.494 -178.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 29.6 mtt85 -68.68 -51.03 46.2 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.43 0.692 . . . . 0.0 112.129 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -61.37 -35.1 76.53 Favored 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 178.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.548 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 95.6 mt -67.0 -45.47 77.51 Favored 'General case' 0 C--O 1.215 -0.75 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.674 173.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.455 ' HB3' ' HG3' ' A' ' 48' ' ' GLU . 1.8 m-85 -60.62 -47.24 87.1 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.883 0.873 . . . . 0.0 111.954 -173.306 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.439 ' HD3' ' HG2' ' A' ' 35' ' ' GLU . 9.0 ptp180 -66.72 -35.43 80.11 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 122.637 0.375 . . . . 0.0 110.273 176.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.422 ' O ' ' HE3' ' A' ' 29' ' ' LYS . 37.1 ttm180 -63.5 -43.63 96.69 Favored 'General case' 0 C--N 1.362 1.11 0 C-N-CA 123.709 0.804 . . . . 0.0 112.031 178.639 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 2.7 pp -86.09 -21.23 27.76 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 122.977 0.511 . . . . 0.0 111.319 -176.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 57.6 m-70 -90.3 26.64 1.87 Allowed 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 171.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.422 ' HE3' ' O ' ' A' ' 26' ' ' ARG . 9.7 ptpp? -48.35 -30.14 4.64 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 126.21 1.804 . . . . 0.0 113.942 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.412 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -62.39 -26.4 40.3 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 124.38 1.072 . . . . 0.0 112.344 -177.689 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -122.38 -35.96 3.03 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.639 0.776 . . . . 0.0 111.087 -178.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -79.75 94.19 5.71 Favored 'General case' 0 C--N 1.348 0.505 0 C-N-CA 123.897 0.879 . . . . 0.0 109.555 -177.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -121.75 -39.09 2.66 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.734 1.214 . . . . 0.0 108.335 176.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -105.66 77.08 1.24 Allowed 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.657 178.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.439 ' HG2' ' HD3' ' A' ' 25' ' ' ARG . 5.9 mp0 -70.62 -65.02 0.79 Allowed 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 106.861 -1.533 . . . . 0.0 106.861 167.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -117.72 154.99 51.13 Favored Pre-proline 0 CA--C 1.539 0.554 0 CA-C-N 114.448 -1.251 . . . . 0.0 109.008 178.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -52.67 -61.81 0.44 Allowed 'Trans proline' 0 C--N 1.38 2.201 0 C-N-CA 122.947 2.431 . . . . 0.0 112.518 175.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.2 ptt180 -168.15 58.28 0.06 Allowed 'General case' 0 N--CA 1.48 1.027 0 CA-C-O 122.269 1.033 . . . . 0.0 109.232 174.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -91.37 143.21 27.87 Favored Pre-proline 0 N--CA 1.478 0.928 0 CA-C-N 114.876 -1.056 . . . . 0.0 111.268 -175.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -61.84 137.7 69.53 Favored 'Trans proline' 0 C--N 1.38 2.209 0 C-N-CA 122.858 2.372 . . . . 0.0 110.994 171.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -56.82 100.76 0.05 OUTLIER 'General case' 0 N--CA 1.485 1.281 0 O-C-N 123.978 0.799 . . . . 0.0 110.043 175.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -148.58 -69.75 0.22 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.486 0.714 . . . . 0.0 109.467 -170.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -93.22 -58.24 2.37 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 49.8 50.5 18.27 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 125.26 1.424 . . . . 0.0 110.157 178.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -59.22 -62.33 1.96 Allowed 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.487 -172.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 62.4 -177.73 0.13 Allowed 'General case' 0 N--CA 1.477 0.891 0 O-C-N 124.524 1.14 . . . . 0.0 112.624 -177.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 28.1 t -158.47 35.74 0.23 Allowed 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 177.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.455 ' HG3' ' HB3' ' A' ' 24' ' ' TYR . 0.7 OUTLIER -61.62 150.1 37.32 Favored 'General case' 0 C--N 1.353 0.725 0 CA-C-N 114.695 -1.139 . . . . 0.0 111.996 -173.375 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -66.52 89.62 0.15 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 124.54 1.136 . . . . 0.0 110.971 -178.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 37.1 p -78.91 135.78 37.08 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.714 176.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 59.28 82.43 0.15 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.855 1.262 . . . . 0.0 110.081 -175.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -144.99 87.46 1.83 Allowed 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 114.855 -1.066 . . . . 0.0 108.153 -174.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 59.79 177.71 0.09 Allowed 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 125.124 1.37 . . . . 0.0 113.13 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 95.2 t -77.22 -59.98 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 174.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 32.6 tp 53.63 109.77 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 125.771 1.628 . . . . 0.0 112.816 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -62.09 -24.6 67.22 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 123.183 0.593 . . . . 0.0 111.773 178.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -74.85 1.71 11.98 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.509 0.724 . . . . 0.0 112.442 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.469 HD13 HD11 ' A' ' 27' ' ' LEU . 19.1 mt -76.11 -63.67 1.27 Allowed 'General case' 0 C--N 1.354 0.785 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 171.738 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 119.82 146.1 7.66 Favored Glycine 0 N--CA 1.475 1.278 0 CA-C-O 119.253 -0.749 . . . . 0.0 111.651 177.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 60.3 tt0 -58.08 -50.9 71.84 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.047 0.939 . . . . 0.0 111.892 -173.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 7.1 p -54.74 -38.79 44.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 123.71 0.804 . . . . 0.0 111.402 179.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -71.3 -53.5 10.3 Favored Glycine 0 C--N 1.346 1.124 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.797 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -65.46 -38.11 88.86 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 124.249 1.02 . . . . 0.0 111.534 -175.065 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -69.13 -43.29 74.68 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.889 0.876 . . . . 0.0 110.252 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -70.41 -35.64 73.55 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.577 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.3 mp -63.15 -39.59 95.1 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.215 1.006 . . . . 0.0 110.792 175.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 52.6 ttt180 -59.89 -45.7 91.7 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.932 0.893 . . . . 0.0 110.026 175.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.494 ' HB2' ' O ' ' A' ' 101' ' ' TYR . . . -64.87 -44.79 88.53 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 114.713 -1.131 . . . . 0.0 111.922 -178.272 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.572 HG23 ' HB3' ' A' ' 20' ' ' GLN . 83.3 mt -70.74 -44.64 76.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 123.581 0.752 . . . . 0.0 110.81 -178.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -68.2 -37.48 80.95 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.365 0.666 . . . . 0.0 110.835 -175.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.454 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -64.93 -43.08 93.95 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.795 0.684 . . . . 0.0 110.232 176.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.428 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -62.09 -45.5 93.22 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 123.884 0.74 . . . . 0.0 110.996 177.649 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.515 HD22 HD12 ' A' ' 76' ' ' ILE . 86.2 mt -63.31 -34.92 78.73 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 124.263 1.025 . . . . 0.0 111.589 176.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.44 -35.92 81.51 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.464 0.706 . . . . 0.0 110.711 177.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.454 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 52.6 mtp85 -72.77 -29.09 63.01 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.987 176.511 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.515 HD12 HD22 ' A' ' 73' ' ' LEU . 84.0 mt -66.99 -44.08 88.68 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 122.574 0.35 . . . . 0.0 110.084 176.252 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.1 -35.23 80.48 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.521 0.729 . . . . 0.0 111.119 177.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.42 ' HB3' HG21 ' A' ' 80' ' ' THR . 32.4 t -79.64 -19.8 48.28 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 123.604 0.762 . . . . 0.0 111.358 177.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 80.58 12.1 83.31 Favored Glycine 0 C--N 1.351 1.365 0 C-N-CA 123.034 0.349 . . . . 0.0 113.6 -178.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.42 HG21 ' HB3' ' A' ' 78' ' ' SER . 10.2 t -110.28 21.54 16.59 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 124.279 1.032 . . . . 0.0 110.781 179.558 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 75.6 t80 -60.14 145.26 47.51 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.118 0.567 . . . . 0.0 111.595 171.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 75.11 38.53 39.83 Favored Glycine 0 C--N 1.348 1.247 0 O-C-N 124.016 0.823 . . . . 0.0 111.926 -176.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 40.5 m -127.78 117.9 22.73 Favored 'General case' 0 C--O 1.243 0.731 0 C-N-CA 124.014 0.926 . . . . 0.0 109.16 175.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 51.2 t -61.49 102.7 0.26 Allowed 'General case' 0 C--N 1.351 0.649 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 169.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 23.1 m -56.69 -38.42 57.73 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 C-N-CA 124.312 1.045 . . . . 0.0 111.562 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -68.77 -21.65 64.34 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.07 0.948 . . . . 0.0 111.361 -177.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 59.9 m -105.24 -29.65 10.18 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.398 0.679 . . . . 0.0 111.962 178.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 66.34 32.08 80.89 Favored Glycine 0 CA--C 1.536 1.35 0 N-CA-C 111.624 -0.59 . . . . 0.0 111.624 -161.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -130.73 -178.44 4.8 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.971 0.909 . . . . 0.0 110.999 -174.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 25.8 mmm180 -71.99 159.95 33.35 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.832 0.853 . . . . 0.0 113.17 -175.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 39.2 mm -106.93 147.0 12.62 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 CA-C-N 114.521 -1.218 . . . . 0.0 108.196 163.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 13.2 m -73.97 149.78 41.14 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.418 0.687 . . . . 0.0 110.252 178.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.639 ' HB2' ' HB2' ' A' ' 6' ' ' SER . 32.2 tt0 -58.8 -45.16 90.56 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.48 0.712 . . . . 0.0 110.23 175.418 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.419 ' HA ' ' HE3' ' A' ' 97' ' ' LYS . 38.0 m-20 -65.32 -31.87 73.23 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.457 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.514 ' HE ' ' HA ' ' A' ' 95' ' ' ARG . 2.1 tpm_? -70.79 -40.75 72.37 Favored 'General case' 0 C--O 1.216 -0.687 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.095 175.278 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 79.5 mt -70.63 -39.53 73.63 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.377 0.671 . . . . 0.0 111.723 -178.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.419 ' HE3' ' HA ' ' A' ' 94' ' ' ASP . 16.0 ptpt -71.81 -31.88 67.01 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 122.684 0.394 . . . . 0.0 110.312 -176.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -77.17 -58.24 3.39 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.073 0.549 . . . . 0.0 110.386 174.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.6 p -130.98 95.2 26.06 Favored Pre-proline 0 CA--C 1.562 1.427 0 C-N-CA 124.81 1.244 . . . . 0.0 109.857 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -80.14 -11.66 13.37 Favored 'Trans proline' 0 C--N 1.378 2.106 0 C-N-CA 122.71 2.273 . . . . 0.0 112.929 177.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . 0.494 ' O ' ' HB2' ' A' ' 68' ' ' ALA . 10.2 p90 -95.74 36.29 1.3 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.329 0.651 . . . . 0.0 111.069 179.678 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 15.0 t -106.78 120.26 48.79 Favored Pre-proline 0 CA--C 1.555 1.159 0 O-C-N 122.088 -0.382 . . . . 0.0 110.506 177.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -78.41 -9.37 16.22 Favored 'Trans proline' 0 C--N 1.376 2.013 0 C-N-CA 122.361 2.04 . . . . 0.0 112.097 168.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.407 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 14.9 m-85 -118.13 159.04 23.96 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.043 0.537 . . . . 0.0 110.465 -174.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 31.1 p -85.81 169.5 13.3 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 174.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.492 ' HB2' ' HD2' ' A' ' 95' ' ' ARG . 36.1 tt0 -59.32 -28.39 66.77 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 122.985 0.514 . . . . 0.0 111.439 -176.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -70.04 -47.17 63.14 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.319 1.048 . . . . 0.0 109.851 -178.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.407 ' HB2' ' HB3' ' A' ' 104' ' ' PHE . 94.0 m -68.44 -36.08 78.52 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.1 175.37 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -62.8 -36.58 83.61 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.161 0.985 . . . . 0.0 111.058 178.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.29 -33.74 70.01 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.575 174.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -80.23 -10.07 59.75 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 123.67 0.788 . . . . 0.0 112.84 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 82.2 mt . . . . . 0 C--O 1.254 1.339 0 C-N-CA 123.089 0.556 . . . . 0.0 110.984 -179.147 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 55.6 tp . . . . . 0 N--CA 1.473 0.688 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 68.01 -71.97 0.1 Allowed 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 125.472 1.509 . . . . 0.0 111.408 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.41 ' HA2' ' HB2' ' A' ' 10' ' ' GLU . . . 72.1 -77.88 0.68 Allowed Glycine 0 C--N 1.357 1.698 0 C-N-CA 123.433 0.539 . . . . 0.0 113.177 175.028 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -132.64 63.4 0.62 Allowed Glycine 0 C--N 1.34 0.783 0 N-CA-C 110.272 -1.131 . . . . 0.0 110.272 175.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.2 ttpp -74.52 -60.8 2.11 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-O 121.42 0.628 . . . . 0.0 110.66 -174.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 30.4 t -142.64 14.26 1.95 Allowed 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.987 0.915 . . . . 0.0 109.442 176.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' MET . . . . . 0.532 ' HE3' ' HA3' ' A' ' 82' ' ' GLY . 22.1 ptp -175.51 173.12 2.51 Favored 'General case' 0 C--O 1.241 0.637 0 C-N-CA 125.767 1.627 . . . . 0.0 107.582 -175.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -79.68 70.86 6.26 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 176.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 22.8 t -63.33 -37.68 80.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.959 -173.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.41 ' HB2' ' HA2' ' A' ' 3' ' ' GLY . 42.4 tt0 -58.47 -41.16 84.62 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 124.192 0.933 . . . . 0.0 110.845 -178.592 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.3 m -58.54 -47.24 84.87 Favored 'General case' 0 C--N 1.351 0.654 0 O-C-N 124.097 0.873 . . . . 0.0 110.611 176.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 51.8 m-85 -67.87 -37.72 82.16 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 124.335 1.022 . . . . 0.0 111.361 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.451 ' O ' ' HG3' ' A' ' 17' ' ' ARG . 2.4 tm-20 -60.97 -56.49 20.45 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.29 1.036 . . . . 0.0 110.145 -176.177 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -72.13 -35.65 69.18 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.048 -175.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.439 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 11.4 tt -66.72 -33.9 66.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 CA-C-N 118.368 0.531 . . . . 0.0 110.128 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.491 ' HB3' HG21 ' A' ' 69' ' ' ILE . 64.0 mt -67.48 -38.32 84.2 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 122.964 0.506 . . . . 0.0 110.557 174.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.492 ' O ' ' HG2' ' A' ' 21' ' ' ARG . 15.5 mtm180 -64.79 -46.05 83.67 Favored 'General case' 0 C--N 1.353 0.732 0 O-C-N 123.314 0.384 . . . . 0.0 110.29 176.362 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.78 -46.76 88.15 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.527 0.731 . . . . 0.0 111.058 -177.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.439 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -65.74 -41.11 92.55 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.637 178.933 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.636 ' HB3' HG23 ' A' ' 69' ' ' ILE . 1.4 pt20 -67.12 -36.86 82.81 Favored 'General case' 0 C--O 1.206 -1.207 0 CA-C-O 118.937 -0.554 . . . . 0.0 110.091 -179.444 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.492 ' HG2' ' O ' ' A' ' 17' ' ' ARG . 4.2 mmp_? -61.12 -50.37 73.49 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 118.18 0.445 . . . . 0.0 110.899 -178.056 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -64.64 -33.37 75.77 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 123.511 0.507 . . . . 0.0 111.461 177.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.543 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 77.6 mt -77.35 -31.89 54.73 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 122.967 0.507 . . . . 0.0 112.105 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.43 ' HD1' ' O ' ' A' ' 20' ' ' GLN . 3.6 m-85 -65.51 -48.58 72.04 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -179.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 20.6 ptt180 -73.02 -26.11 61.2 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.137 178.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 38.4 ttm-85 -59.1 -56.86 16.73 Favored 'General case' 0 C--N 1.36 1.059 0 C-N-CA 123.234 0.614 . . . . 0.0 110.513 173.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 2.4 pp -82.05 -24.63 35.2 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -173.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 -89.49 27.23 1.51 Allowed 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 123.243 0.617 . . . . 0.0 109.892 171.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 9.8 ptpp? -42.74 -34.11 0.86 Allowed 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 126.541 1.936 . . . . 0.0 114.235 174.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.439 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -68.1 -28.98 43.05 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 C-N-CA 124.195 0.998 . . . . 0.0 112.845 -176.835 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -105.68 -24.91 12.44 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 123.557 0.743 . . . . 0.0 110.542 175.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -92.34 97.63 10.99 Favored 'General case' 0 C--O 1.243 0.751 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -179.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -59.05 128.1 35.52 Favored 'General case' 0 C--O 1.243 0.736 0 O-C-N 124.041 0.838 . . . . 0.0 110.784 -179.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -66.54 81.36 0.1 Allowed 'General case' 0 N--CA 1.472 0.634 0 O-C-N 124.148 0.905 . . . . 0.0 110.159 172.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -93.05 -23.05 18.78 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 114.848 -1.069 . . . . 0.0 109.534 175.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 57.28 81.76 0.25 Allowed Pre-proline 0 C--N 1.356 0.872 0 C-N-CA 124.301 1.04 . . . . 0.0 108.959 -170.097 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -56.2 93.46 0.05 OUTLIER 'Trans proline' 0 C--N 1.381 2.251 0 C-N-CA 122.986 2.457 . . . . 0.0 112.748 -176.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 33.4 mmt180 -77.33 -14.98 59.62 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.037 173.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -95.43 142.97 25.33 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 124.797 1.239 . . . . 0.0 108.566 172.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -78.84 9.89 3.1 Favored 'Trans proline' 0 C--N 1.377 2.061 0 C-N-CA 123.083 2.522 . . . . 0.0 113.803 -178.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -67.16 -15.65 63.83 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.964 1.306 . . . . 0.0 112.128 -179.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -65.41 -13.55 58.92 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.185 0.994 . . . . 0.0 112.393 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -52.71 -48.17 66.82 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.594 1.158 . . . . 0.0 111.086 172.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -75.56 -17.26 60.11 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 114.592 -1.185 . . . . 0.0 111.818 -176.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -75.24 81.28 2.36 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.465 0.706 . . . . 0.0 109.355 176.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -103.88 96.81 6.94 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-N 114.887 -1.051 . . . . 0.0 109.228 177.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.5 m -66.49 89.62 0.15 Allowed 'General case' 0 CA--C 1.547 0.856 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.629 174.447 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -87.17 154.46 20.71 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.584 0.754 . . . . 0.0 109.021 178.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? 61.85 105.67 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.22 0 O-C-N 124.083 0.864 . . . . 0.0 109.672 -165.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.6 m -61.07 -84.08 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 123.458 0.703 . . . . 0.0 111.438 -175.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 167.88 135.33 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 126.231 1.813 . . . . 0.0 107.243 -174.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -88.03 -31.75 19.14 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-O 121.253 0.549 . . . . 0.0 110.261 -177.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -72.99 150.27 42.6 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 114.897 -1.047 . . . . 0.0 108.951 -179.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 22.0 t -64.33 -51.76 64.27 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 175.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.5 tp 60.31 103.32 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 125.151 1.38 . . . . 0.0 111.976 172.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -65.05 -20.4 66.47 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.586 0.754 . . . . 0.0 111.733 -177.044 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -66.42 -14.73 62.58 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 124.2 1.0 . . . . 0.0 112.357 179.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.457 HD21 HD11 ' A' ' 27' ' ' LEU . 79.1 mt -79.02 -69.67 0.56 Allowed 'General case' 0 C--N 1.35 0.618 0 C-N-CA 122.918 0.487 . . . . 0.0 111.857 -177.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 119.61 124.84 3.28 Favored Glycine 0 N--CA 1.472 1.096 0 N-CA-C 110.641 -0.984 . . . . 0.0 110.641 -175.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -58.65 -49.71 76.52 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 124.389 1.076 . . . . 0.0 112.734 -167.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.424 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 8.4 p -57.1 -42.74 80.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 O-C-N 124.004 0.815 . . . . 0.0 111.545 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.41 -38.63 70.07 Favored Glycine 0 C--N 1.348 1.199 0 O-C-N 123.82 0.7 . . . . 0.0 112.822 -177.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -63.75 -48.47 76.85 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.615 0.766 . . . . 0.0 111.488 -178.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -72.14 -23.57 61.32 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.869 179.415 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.424 ' HB2' ' O ' ' A' ' 61' ' ' VAL . 12.8 tt0 -74.97 -39.26 61.39 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 176.302 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 7.2 mp -63.67 -43.14 97.57 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.841 0.856 . . . . 0.0 110.153 173.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -60.5 -39.68 88.6 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 123.68 0.612 . . . . 0.0 109.881 179.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.12 -38.57 75.61 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.901 0.88 . . . . 0.0 111.636 178.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.636 HG23 ' HB3' ' A' ' 20' ' ' GLN . 78.5 mt -69.88 -57.61 7.76 Favored 'Isoleucine or valine' 0 C--N 1.363 1.153 0 C-N-CA 123.172 0.589 . . . . 0.0 110.765 -179.216 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -62.71 -28.95 70.3 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.368 1.067 . . . . 0.0 111.739 -178.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.439 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -69.05 -44.16 73.2 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 122.705 0.402 . . . . 0.0 110.037 172.206 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -66.11 -32.32 73.71 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.817 0.847 . . . . 0.0 111.274 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 90.4 mt -70.7 -37.31 73.57 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.963 0.905 . . . . 0.0 110.254 174.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.57 -26.91 65.64 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.758 0.823 . . . . 0.0 111.229 174.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.439 ' HG2' ' O ' ' A' ' 71' ' ' ALA . 5.7 mmp_? -70.32 -40.2 74.32 Favored 'General case' 0 C--N 1.357 0.908 0 C-N-CA 122.997 0.519 . . . . 0.0 109.799 173.486 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 81.8 mt -66.12 -43.42 92.21 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.243 0 C-N-CA 123.397 0.679 . . . . 0.0 110.292 178.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.29 -39.88 94.41 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.261 1.025 . . . . 0.0 110.775 178.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.433 ' HB3' HG23 ' A' ' 80' ' ' THR . 47.1 t -77.13 -24.73 51.62 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.677 0.791 . . . . 0.0 111.299 177.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 86.82 13.42 66.95 Favored Glycine 0 C--N 1.347 1.177 0 C-N-CA 123.169 0.414 . . . . 0.0 113.045 -176.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.433 HG23 ' HB3' ' A' ' 78' ' ' SER . 14.8 t -110.84 24.38 13.01 Favored 'General case' 0 CA--C 1.557 1.215 0 C-N-CA 124.329 1.051 . . . . 0.0 110.825 -179.087 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -70.95 142.92 51.03 Favored 'General case' 0 N--CA 1.477 0.913 0 O-C-N 121.977 -0.452 . . . . 0.0 109.95 168.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.532 ' HA3' ' HE3' ' A' ' 7' ' ' MET . . . 77.29 26.97 60.56 Favored Glycine 0 C--N 1.346 1.098 0 O-C-N 123.903 0.752 . . . . 0.0 111.741 -173.135 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 49.3 m -122.77 119.71 31.42 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 124.142 0.977 . . . . 0.0 110.028 177.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.411 ' HB2' ' HB3' ' A' ' 105' ' ' CYS . 29.5 t -63.07 94.06 0.07 Allowed 'General case' 0 C--N 1.349 0.572 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 166.581 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 34.8 m -64.98 -25.73 38.4 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 C-N-CA 124.146 0.978 . . . . 0.0 111.248 -174.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.554 ' HD3' ' HB3' ' A' ' 108' ' ' CYS . 57.7 tttm -73.94 -14.64 61.08 Favored 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 124.723 1.209 . . . . 0.0 112.159 -177.342 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.523 ' HB2' ' HG2' ' A' ' 89' ' ' LYS . 4.3 m -132.31 -21.0 2.35 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -175.926 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 69.95 52.62 18.3 Favored Glycine 0 C--N 1.347 1.173 0 O-C-N 123.228 0.33 . . . . 0.0 112.623 -169.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.523 ' HG2' ' HB2' ' A' ' 87' ' ' CYS . 19.5 ptpt -143.88 -167.97 2.73 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.547 0.739 . . . . 0.0 109.558 176.179 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.3 mmm180 -76.65 160.85 29.03 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.962 0.905 . . . . 0.0 113.411 -178.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 19.1 mm -104.57 144.18 14.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 114.342 -1.299 . . . . 0.0 107.542 159.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.8 p -73.93 152.97 40.0 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.589 0.756 . . . . 0.0 110.767 176.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -68.45 -36.95 79.75 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.064 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -59.35 -40.4 86.26 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.031 0.933 . . . . 0.0 111.159 175.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 29.4 tpt180 -64.06 -45.32 89.31 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.143 175.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 95.7 mt -71.02 -32.92 69.83 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.407 0.683 . . . . 0.0 112.763 -175.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.3 ptpt -81.75 -27.43 33.82 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.489 0.315 . . . . 0.0 110.433 -177.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -78.43 -43.82 26.3 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.588 0.755 . . . . 0.0 110.493 174.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.7 p -152.86 95.38 3.03 Favored Pre-proline 0 CA--C 1.557 1.23 0 C-N-CA 124.478 1.111 . . . . 0.0 109.2 -176.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -74.44 -9.82 21.8 Favored 'Trans proline' 0 C--N 1.376 2.014 0 C-N-CA 122.615 2.21 . . . . 0.0 112.487 175.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 11.1 p90 -102.92 67.01 0.94 Allowed 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.206 1.002 . . . . 0.0 108.965 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 10.4 t -140.92 117.91 7.74 Favored Pre-proline 0 CA--C 1.551 0.983 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.575 177.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.23 -24.34 23.33 Favored 'Trans proline' 0 C--N 1.373 1.838 0 C-N-CA 122.262 1.975 . . . . 0.0 111.8 173.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -105.54 144.82 31.77 Favored 'General case' 0 C--N 1.352 0.713 0 CA-C-O 122.305 1.05 . . . . 0.0 111.133 -176.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.836 ' SG ' ' HB2' ' A' ' 108' ' ' CYS . 3.5 p -64.3 164.97 10.25 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 113.628 -1.624 . . . . 0.0 110.556 167.648 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.2 tt0 -55.34 -51.82 65.5 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 123.895 0.878 . . . . 0.0 112.367 -174.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.56 -29.82 52.34 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -174.569 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.836 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 75.7 m -78.34 -25.61 46.48 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.358 0.263 . . . . 0.0 111.366 177.072 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.05 -35.45 69.33 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 123.705 0.628 . . . . 0.0 109.878 169.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.38 -29.09 63.44 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.82 0.848 . . . . 0.0 112.054 178.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -117.32 33.13 5.78 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.689 0.796 . . . . 0.0 111.462 -174.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.475 HD22 ' HE3' ' A' ' 86' ' ' LYS . 54.6 mt . . . . . 0 N--CA 1.492 1.628 0 C-N-CA 123.678 0.791 . . . . 0.0 111.25 175.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 4.7 tt . . . . . 0 N--CA 1.482 1.171 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 64.04 -77.33 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 125.086 1.354 . . . . 0.0 111.123 -178.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -80.65 -64.47 1.81 Allowed Glycine 0 C--N 1.347 1.152 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 172.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 85.06 21.97 53.76 Favored Glycine 0 C--N 1.354 1.57 0 N-CA-C 114.148 0.419 . . . . 0.0 114.148 177.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? -83.82 -7.05 59.54 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.635 0.774 . . . . 0.0 112.019 -178.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 32.7 t -113.65 150.07 33.72 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 171.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 54.9 ttm -65.6 -35.61 81.32 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 122.651 0.381 . . . . 0.0 110.072 177.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 55.4 t30 58.97 68.81 0.78 Allowed 'General case' 0 C--O 1.246 0.906 0 C-N-CA 124.935 1.294 . . . . 0.0 110.121 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 81.7 t -65.5 -32.44 58.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 CA-C-N 114.238 -1.346 . . . . 0.0 111.135 -177.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -59.58 -36.34 76.05 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.191 0.996 . . . . 0.0 112.599 -176.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 71.9 m -69.88 -39.21 76.43 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 122.715 0.406 . . . . 0.0 111.064 176.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -68.99 -34.27 75.03 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.098 0.559 . . . . 0.0 110.043 175.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -63.22 -56.23 18.38 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.749 1.22 . . . . 0.0 109.259 -177.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.444 ' NZ ' ' HB2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -67.61 -39.84 84.71 Favored 'General case' 0 C--O 1.219 -0.545 0 CA-C-N 115.696 -0.683 . . . . 0.0 112.164 -175.057 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 13.5 tt -64.98 -31.77 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 CA-C-O 120.965 0.412 . . . . 0.0 110.242 -177.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.58 ' HB3' HG23 ' A' ' 69' ' ' ILE . 64.4 mt -69.63 -42.0 74.89 Favored 'General case' 0 C--N 1.349 0.556 0 C-N-CA 123.368 0.667 . . . . 0.0 110.847 174.084 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.487 ' O ' ' HG2' ' A' ' 21' ' ' ARG . 1.8 mmp_? -61.67 -46.35 90.1 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 123.388 0.675 . . . . 0.0 110.361 177.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -59.11 -47.34 85.61 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.583 0.753 . . . . 0.0 110.551 178.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -66.43 -41.27 89.44 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 114.806 -1.088 . . . . 0.0 111.544 -176.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.604 ' HB3' HG22 ' A' ' 69' ' ' ILE . 2.8 pt20 -71.68 -32.99 68.44 Favored 'General case' 0 C--O 1.212 -0.918 0 CA-C-O 118.525 -0.75 . . . . 0.0 110.673 -177.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.487 ' HG2' ' O ' ' A' ' 17' ' ' ARG . 22.9 mmt180 -67.6 -46.81 71.5 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.192 0.597 . . . . 0.0 110.826 -177.437 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -66.54 -32.88 74.5 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.871 178.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.533 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 89.4 mt -77.58 -32.24 53.57 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-O 118.631 -0.7 . . . . 0.0 111.842 176.364 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -58.54 -54.46 46.75 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 123.239 0.616 . . . . 0.0 109.507 178.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.5 ptt180 -72.83 -25.84 61.27 Favored 'General case' 0 CA--C 1.549 0.913 0 CA-C-N 114.832 -1.076 . . . . 0.0 111.522 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 52.3 ttm-85 -63.15 -52.08 63.89 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.022 0.529 . . . . 0.0 112.102 175.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.605 HD23 HD22 ' A' ' 66' ' ' LEU . 2.9 pp -81.44 -25.67 35.94 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 122.334 -0.229 . . . . 0.0 111.02 -178.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 6.1 m170 -86.87 32.26 0.68 Allowed 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 122.952 0.501 . . . . 0.0 110.594 169.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 20.2 pttp -61.63 -29.42 70.04 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 124.511 1.124 . . . . 0.0 112.069 176.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.429 ' H ' HD12 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -63.9 -26.11 39.78 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 123.521 0.728 . . . . 0.0 111.618 174.96 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -97.45 -34.21 11.1 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.459 1.104 . . . . 0.0 110.551 177.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -89.75 118.93 29.72 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.133 -0.939 . . . . 0.0 110.72 -171.228 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -73.79 -7.85 53.74 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.781 0.832 . . . . 0.0 111.309 173.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 63.8 t80 67.16 75.47 0.31 Allowed 'General case' 0 C--N 1.356 0.88 0 C-N-CA 125.754 1.621 . . . . 0.0 109.668 179.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -71.03 -39.28 72.43 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 114.869 -1.059 . . . . 0.0 109.247 170.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 69.06 110.56 0.03 OUTLIER Pre-proline 0 C--N 1.36 1.048 0 O-C-N 124.977 1.423 . . . . 0.0 110.623 -178.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -69.09 109.85 2.28 Favored 'Trans proline' 0 C--N 1.369 1.613 0 C-N-CA 121.714 1.609 . . . . 0.0 110.047 168.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -61.68 -19.5 62.42 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.06 0.944 . . . . 0.0 111.517 -179.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -136.67 150.49 70.29 Favored Pre-proline 0 CA--C 1.542 0.665 0 C-N-CA 124.579 1.152 . . . . 0.0 108.312 169.401 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -74.35 75.93 3.26 Favored 'Trans proline' 0 C--N 1.374 1.92 0 C-N-CA 122.439 2.093 . . . . 0.0 110.418 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -72.46 -37.87 68.4 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 114.629 -1.169 . . . . 0.0 108.908 -179.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -83.83 73.43 10.31 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 114.31 -1.314 . . . . 0.0 109.869 176.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -59.39 -48.02 83.21 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 114.654 -1.157 . . . . 0.0 108.97 172.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.479 ' HB2' ' HD3' ' A' ' 17' ' ' ARG . 24.4 t70 -159.9 90.44 0.92 Allowed 'General case' 0 C--O 1.239 0.533 0 CA-C-N 114.339 -1.301 . . . . 0.0 108.012 168.1 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -97.62 52.82 1.11 Allowed 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 -178.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 64.96 153.1 0.06 Allowed 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 125.135 1.374 . . . . 0.0 112.467 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.9 p -118.82 -83.09 0.65 Allowed 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 175.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 61.78 168.56 0.11 Allowed 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.689 1.196 . . . . 0.0 112.926 174.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 52.78 -96.22 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.709 1.204 . . . . 0.0 110.13 -173.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.8 m 57.19 170.03 0.04 OUTLIER 'General case' 0 C--N 1.363 1.181 0 C-N-CA 125.416 1.486 . . . . 0.0 112.407 -177.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.0 t-20 66.03 177.91 0.21 Allowed 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.607 0.763 . . . . 0.0 109.97 177.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.4 t70 64.49 17.25 10.73 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 122.188 0.994 . . . . 0.0 110.21 -176.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -88.18 70.89 9.26 Favored 'General case' 0 C--O 1.246 0.884 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 -179.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 41.7 t -66.98 -25.31 34.02 Favored 'Isoleucine or valine' 0 C--O 1.241 0.613 0 CA-C-N 113.714 -1.585 . . . . 0.0 110.666 -173.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.8 tp -56.15 110.84 0.82 Allowed 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.94 0.896 . . . . 0.0 110.547 178.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -79.25 -3.15 44.54 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 123.69 0.796 . . . . 0.0 111.264 -174.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -66.78 -12.36 58.53 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.569 0.748 . . . . 0.0 111.861 174.113 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 12.5 mt -73.79 131.74 41.87 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 171.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -60.79 130.74 48.38 Favored Glycine 0 C--N 1.346 1.085 0 CA-C-O 119.074 -0.848 . . . . 0.0 111.906 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -64.29 -43.2 95.48 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.244 0.617 . . . . 0.0 111.104 -174.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 7.8 p -58.9 -35.04 54.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 123.199 0.6 . . . . 0.0 110.958 173.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.43 -43.71 76.82 Favored Glycine 0 C--N 1.345 1.082 0 O-C-N 123.647 0.592 . . . . 0.0 112.205 175.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -67.5 -47.87 68.75 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 124.024 0.93 . . . . 0.0 111.554 -176.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -67.66 -39.3 84.55 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.445 0.698 . . . . 0.0 110.806 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.4 ' O ' HG13 ' A' ' 69' ' ' ILE . 24.7 tt0 -70.75 -33.17 70.53 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 123.44 0.463 . . . . 0.0 110.129 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.605 HD22 HD23 ' A' ' 27' ' ' LEU . 2.5 mp -66.18 -41.33 90.43 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.344 0.658 . . . . 0.0 110.791 173.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 56.4 ttt180 -58.05 -42.96 86.55 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 123.656 0.597 . . . . 0.0 109.62 175.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.02 -39.71 75.65 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.42 1.088 . . . . 0.0 111.919 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.604 HG22 ' HB3' ' A' ' 20' ' ' GLN . 72.9 mt -68.69 -54.08 23.15 Favored 'Isoleucine or valine' 0 C--N 1.359 1.012 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -178.488 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -67.09 -23.27 65.83 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.331 1.052 . . . . 0.0 112.605 179.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.468 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -65.85 -54.56 25.1 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 170.505 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.482 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -58.81 -42.38 89.03 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 124.448 1.092 . . . . 0.0 111.339 -178.361 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.494 HD22 HD12 ' A' ' 76' ' ' ILE . 95.5 mt -68.04 -38.42 82.49 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.319 1.047 . . . . 0.0 111.721 179.469 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.34 -33.0 74.93 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.173 0.589 . . . . 0.0 110.394 174.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.468 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 80.5 mtt-85 -74.91 -27.4 60.2 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.588 0.755 . . . . 0.0 111.36 177.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.494 HD12 HD22 ' A' ' 73' ' ' LEU . 76.2 mt -69.89 -44.6 78.63 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 174.129 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.37 -32.97 74.88 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 114.825 -1.08 . . . . 0.0 111.324 176.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 26.6 t -84.08 -23.2 30.91 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.439 0.696 . . . . 0.0 111.627 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 86.95 16.63 60.86 Favored Glycine 0 C--N 1.35 1.31 0 O-C-N 123.298 0.374 . . . . 0.0 113.785 -178.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.4 t -114.36 18.83 16.68 Favored 'General case' 0 CA--C 1.559 1.291 0 C-N-CA 124.111 0.964 . . . . 0.0 111.372 178.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -72.66 137.61 46.15 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 170.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.444 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 88.5 11.42 66.37 Favored Glycine 0 CA--C 1.528 0.857 0 O-C-N 123.987 0.804 . . . . 0.0 111.918 -171.444 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 22.7 m -118.79 118.2 30.95 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.511 0.724 . . . . 0.0 109.656 175.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 46.5 t -74.2 92.84 2.26 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.898 171.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 27.0 m -66.84 -14.45 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 124.041 0.936 . . . . 0.0 112.755 -177.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 47.7 tttm -76.49 -17.41 59.3 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.152 0.581 . . . . 0.0 111.844 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 31.0 p -144.26 8.6 1.4 Allowed 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 176.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 62.43 32.38 82.82 Favored Glycine 0 C--N 1.358 1.759 0 C-N-CA 123.247 0.451 . . . . 0.0 114.196 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 32.3 mmmt -116.05 -171.39 1.98 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.499 0.72 . . . . 0.0 110.067 -176.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.444 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 24.2 tpp180 -89.12 151.42 22.22 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.176 0.991 . . . . 0.0 110.364 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 9.8 mm -92.5 138.74 19.32 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 165.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 39.0 m -73.92 151.38 40.41 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 122.619 0.368 . . . . 0.0 110.54 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -61.36 -41.43 97.06 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.405 0.682 . . . . 0.0 109.896 174.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.412 ' HA ' ' HG2' ' A' ' 97' ' ' LYS . 64.0 m-20 -67.13 -33.58 75.75 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.286 178.369 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.44 ' HG3' HG21 ' A' ' 102' ' ' THR . 1.0 OUTLIER -66.43 -44.1 83.81 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.42 0.688 . . . . 0.0 109.583 174.918 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 79.4 mt -71.19 -36.01 71.78 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.764 0.826 . . . . 0.0 112.037 -177.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.412 ' HG2' ' HA ' ' A' ' 94' ' ' ASP . 16.0 ptpt -77.08 -28.18 54.52 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 110.256 -0.275 . . . . 0.0 110.256 -177.715 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -79.12 -40.48 30.95 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.493 0.717 . . . . 0.0 110.732 175.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.2 p -152.61 94.3 3.19 Favored Pre-proline 0 CA--C 1.556 1.183 0 C-N-CA 124.625 1.17 . . . . 0.0 108.79 -176.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.98 -13.1 19.54 Favored 'Trans proline' 0 C--N 1.375 1.935 0 C-N-CA 122.61 2.207 . . . . 0.0 113.816 -179.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 36.2 p90 -90.69 7.71 38.12 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -179.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.44 HG21 ' HG3' ' A' ' 95' ' ' ARG . 15.0 t -82.74 123.77 77.9 Favored Pre-proline 0 CA--C 1.562 1.418 0 CA-C-N 118.112 0.415 . . . . 0.0 110.735 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -84.29 0.63 9.09 Favored 'Trans proline' 0 C--N 1.368 1.605 0 C-N-CA 122.61 2.207 . . . . 0.0 111.645 167.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -117.39 141.63 48.09 Favored 'General case' 0 C--N 1.353 0.744 0 C-N-CA 123.929 0.892 . . . . 0.0 110.577 -173.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.634 ' SG ' ' HG3' ' A' ' 107' ' ' GLU . 19.8 p -80.18 173.48 12.56 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 174.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -60.96 -35.08 75.84 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -172.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.634 ' HG3' ' SG ' ' A' ' 105' ' ' CYS . 0.0 OUTLIER -72.24 -32.64 66.88 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 178.48 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 91.8 m -73.87 -38.8 64.31 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 122.452 0.301 . . . . 0.0 110.784 173.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.91 -32.54 74.3 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.129 0.972 . . . . 0.0 111.187 175.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.25 -33.45 69.83 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.74 0.816 . . . . 0.0 110.708 174.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -79.4 -10.73 59.87 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.852 177.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 90.3 mt . . . . . 0 C--O 1.25 1.119 0 CA-C-O 118.452 -0.785 . . . . 0.0 109.105 173.013 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.3 pp . . . . . 0 N--CA 1.488 1.426 0 CA-C-O 119.622 -0.228 . . . . 0.0 110.65 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.453 ' HB2' ' HA ' ' A' ' 77' ' ' ALA . . . 69.12 169.78 0.29 Allowed 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 124.795 1.238 . . . . 0.0 113.006 177.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 90.44 178.43 44.1 Favored Glycine 0 C--N 1.347 1.181 0 CA-C-N 116.065 -0.516 . . . . 0.0 113.294 177.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -165.62 116.72 0.71 Allowed Glycine 0 C--N 1.347 1.145 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -96.26 56.36 1.6 Allowed 'General case' 0 N--CA 1.48 1.075 0 CA-C-O 121.696 0.76 . . . . 0.0 109.847 -175.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.2 t -174.73 168.99 3.62 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.575 1.15 . . . . 0.0 109.669 178.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 48.4 ttp 63.05 12.9 6.3 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 124.917 1.287 . . . . 0.0 112.271 172.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 16.7 m120 63.82 25.47 14.08 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 124.839 1.256 . . . . 0.0 112.061 -175.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 37.7 t -50.04 -42.38 19.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 C-N-CA 124.535 1.134 . . . . 0.0 111.817 178.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -70.62 -36.17 73.33 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 123.855 0.722 . . . . 0.0 111.925 -175.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 57.5 m -68.3 -35.77 78.33 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 173.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -70.3 -36.47 74.35 Favored 'General case' 0 C--O 1.215 -0.758 0 C-N-CA 123.252 0.621 . . . . 0.0 110.403 176.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -63.31 -52.19 62.92 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.207 1.003 . . . . 0.0 110.303 -175.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.82 -42.3 95.09 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.471 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.51 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 10.6 tt -69.2 -32.76 55.1 Favored 'Isoleucine or valine' 0 C--N 1.365 1.261 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 -177.039 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.444 ' HB3' HG21 ' A' ' 69' ' ' ILE . 52.8 mt -62.78 -41.87 99.44 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 122.793 0.437 . . . . 0.0 110.451 175.438 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.513 ' O ' ' HG2' ' A' ' 21' ' ' ARG . 17.4 mtm180 -60.83 -52.62 64.28 Favored 'General case' 0 C--O 1.215 -0.737 0 O-C-N 123.626 0.579 . . . . 0.0 109.448 175.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -53.95 -44.86 71.06 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.43 0.692 . . . . 0.0 111.422 -176.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.51 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -61.44 -51.21 69.67 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 124.306 1.004 . . . . 0.0 110.867 178.956 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.616 ' HB3' HG23 ' A' ' 69' ' ' ILE . 1.8 pt20 -67.83 -29.84 69.09 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 122.983 0.177 . . . . 0.0 110.941 -176.071 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.561 ' HB3' ' HB2' ' A' ' 47' ' ' SER . 29.2 mmt180 -71.41 -54.39 10.84 Favored 'General case' 0 C--N 1.354 0.781 0 C-N-CA 123.623 0.769 . . . . 0.0 110.131 -177.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -61.63 -29.93 70.37 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.109 0.564 . . . . 0.0 110.584 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.602 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 82.5 mt -69.83 -43.32 72.22 Favored 'General case' 0 C--O 1.212 -0.869 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.94 170.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.413 ' O ' ' HB2' ' A' ' 28' ' ' HIS . 2.0 m-85 -56.83 -37.15 70.84 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.099 0.56 . . . . 0.0 112.062 -177.612 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.489 HH22 ' ND2' ' A' ' 39' ' ' ASN . 35.7 ptt180 -80.46 -29.7 37.47 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 122.169 0.187 . . . . 0.0 111.172 174.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 47.7 ttt85 -66.83 -37.77 85.13 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.95 0.9 . . . . 0.0 112.23 177.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.602 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 1.7 pp -97.22 -35.48 10.74 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 122.473 0.309 . . . . 0.0 111.288 -177.203 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.413 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 52.1 m-70 -92.2 45.57 1.21 Allowed 'General case' 0 N--CA 1.486 1.335 0 CA-C-O 122.242 1.02 . . . . 0.0 109.341 168.527 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 18.7 pttp -65.12 -21.33 66.78 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 125.502 1.521 . . . . 0.0 112.017 174.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -64.28 -25.82 38.92 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 123.187 0.595 . . . . 0.0 112.226 178.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -113.92 -20.0 11.23 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.763 0.825 . . . . 0.0 110.9 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -92.98 85.3 5.08 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 175.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -105.91 84.3 2.04 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.848 0.859 . . . . 0.0 110.547 -177.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 21.5 t80 62.75 18.71 10.88 Favored 'General case' 0 CA--C 1.562 1.412 0 C-N-CA 124.846 1.258 . . . . 0.0 112.374 170.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -61.63 -43.31 99.1 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-O 121.979 0.895 . . . . 0.0 109.383 175.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.433 ' HG3' HH11 ' A' ' 25' ' ' ARG . 10.2 pt-20 -145.14 112.92 4.81 Favored Pre-proline 0 CA--C 1.549 0.911 0 CA-C-N 113.891 -1.504 . . . . 0.0 107.74 167.345 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.48 178.74 6.96 Favored 'Trans proline' 0 C--N 1.37 1.662 0 C-N-CA 122.662 2.241 . . . . 0.0 112.76 177.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 37.5 ptt180 -52.7 125.57 17.12 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 125.542 1.537 . . . . 0.0 112.16 -177.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.489 ' ND2' HH22 ' A' ' 25' ' ' ARG . 3.9 p30 -135.83 84.21 32.88 Favored Pre-proline 0 CA--C 1.551 1.009 0 C-N-CA 123.387 0.675 . . . . 0.0 109.298 176.174 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -75.49 -23.33 13.12 Favored 'Trans proline' 0 C--N 1.384 2.399 0 C-N-CA 123.059 2.506 . . . . 0.0 112.398 -179.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -91.08 171.01 9.55 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 124.296 1.038 . . . . 0.0 109.946 174.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -72.78 86.82 1.26 Allowed 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 123.512 0.725 . . . . 0.0 111.445 -171.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -114.01 -54.99 2.55 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.122 0.969 . . . . 0.0 108.637 172.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.7 t70 61.25 100.03 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.959 1.304 . . . . 0.0 111.756 175.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 22.5 mmt180 -102.08 -77.72 0.55 Allowed 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 122.749 0.42 . . . . 0.0 110.363 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -161.51 -80.7 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 117.847 0.294 . . . . 0.0 111.062 176.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.561 ' HB2' ' HB3' ' A' ' 21' ' ' ARG . 19.3 m 57.58 27.1 13.65 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 125.066 1.346 . . . . 0.0 110.815 -170.629 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.574 ' HG3' ' HG3' ' A' ' 49' ' ' ARG . 10.3 tp10 -57.94 -59.13 5.72 Favored 'General case' 0 C--N 1.353 0.719 0 C-N-CA 125.002 1.321 . . . . 0.0 112.603 -165.198 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.574 ' HG3' ' HG3' ' A' ' 48' ' ' GLU . 99.7 mtt180 -136.21 169.06 18.24 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.643 0.735 . . . . 0.0 111.258 -174.701 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.8 t -162.91 -171.57 2.73 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 113.946 -1.479 . . . . 0.0 107.995 -173.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -68.77 112.94 5.8 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 165.066 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -69.71 -18.26 63.52 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.497 0.719 . . . . 0.0 111.831 -171.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -67.79 158.98 31.2 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 122.907 0.483 . . . . 0.0 110.822 175.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 90.1 t -69.4 -79.26 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.578 -173.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.477 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 65.5 tp 70.77 137.42 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.851 0 C-N-CA 124.569 1.147 . . . . 0.0 110.655 -172.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -81.06 15.74 1.76 Allowed 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -175.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -91.94 2.29 56.64 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.439 0.695 . . . . 0.0 111.023 173.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 12.4 mt -81.52 167.21 19.56 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.747 0.419 . . . . 0.0 111.046 178.688 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -95.57 132.04 10.92 Favored Glycine 0 C--N 1.346 1.102 0 N-CA-C 110.85 -0.9 . . . . 0.0 110.85 172.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -51.62 -51.99 51.25 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 124.49 1.116 . . . . 0.0 112.906 -175.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 7.4 p -66.49 -32.15 56.75 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 C-N-CA 123.851 0.86 . . . . 0.0 111.003 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -63.46 -36.93 94.03 Favored Glycine 0 C--N 1.347 1.174 0 N-CA-C 111.903 -0.479 . . . . 0.0 111.903 175.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -76.99 -41.12 44.15 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.312 1.045 . . . . 0.0 111.552 -178.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -67.74 -39.06 84.25 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.533 0.733 . . . . 0.0 110.197 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -70.64 -39.7 73.52 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.545 178.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.1 mp -56.2 -47.2 78.84 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.024 0.929 . . . . 0.0 110.313 172.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -63.37 -37.32 86.8 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.704 0.802 . . . . 0.0 110.693 -176.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.75 -37.8 70.49 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.664 0.786 . . . . 0.0 111.182 178.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.616 HG23 ' HB3' ' A' ' 20' ' ' GLN . 85.4 mt -67.32 -52.24 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 123.973 0.909 . . . . 0.0 110.51 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.8 -29.74 70.72 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.24 1.016 . . . . 0.0 111.213 -179.17 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.4 -46.14 81.19 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 122.973 0.509 . . . . 0.0 110.043 173.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.532 ' HB1' ' HE1' ' A' ' 81' ' ' PHE . . . -66.42 -39.98 89.28 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.391 179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.497 HD22 HD12 ' A' ' 76' ' ' ILE . 68.3 mt -69.83 -32.17 70.45 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.06 0.944 . . . . 0.0 111.188 178.508 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.54 -34.82 79.14 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.348 0.659 . . . . 0.0 110.544 174.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.4 ' HA ' ' HD3' ' A' ' 75' ' ' ARG . 17.8 mmt180 -72.04 -37.95 69.63 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.501 176.71 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.497 HD12 HD22 ' A' ' 73' ' ' LEU . 59.6 mt -65.69 -41.62 90.88 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 CA-C-O 121.224 0.535 . . . . 0.0 109.629 175.636 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.453 ' HA ' ' HB2' ' A' ' 2' ' ' ALA . . . -67.66 -25.06 65.52 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.438 1.095 . . . . 0.0 111.933 178.121 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 27.5 t -100.37 2.58 42.54 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 123.739 0.816 . . . . 0.0 111.084 177.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 66.51 19.64 69.06 Favored Glycine 0 C--N 1.358 1.771 0 N-CA-C 114.452 0.541 . . . . 0.0 114.452 176.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 9.0 t -127.4 29.2 5.57 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 124.519 1.127 . . . . 0.0 110.873 -177.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.532 ' HE1' ' HB1' ' A' ' 72' ' ' ALA . 68.5 t80 -59.35 143.67 48.84 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 122.821 0.449 . . . . 0.0 110.317 167.377 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 83.48 33.63 21.93 Favored Glycine 0 C--N 1.34 0.757 0 O-C-N 123.779 0.674 . . . . 0.0 111.623 -173.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 59.1 m -125.66 120.36 30.51 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.385 0.674 . . . . 0.0 110.074 175.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.419 ' HB2' ' HB3' ' A' ' 105' ' ' CYS . 48.7 t -76.66 102.18 6.06 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 123.807 0.843 . . . . 0.0 110.613 175.131 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 16.4 m -74.2 -11.45 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 124.157 0.983 . . . . 0.0 112.408 -175.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 52.4 tttm -81.03 -24.83 37.61 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.073 0.549 . . . . 0.0 111.381 -178.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.442 ' SG ' ' HB2' ' A' ' 89' ' ' LYS . 23.3 p -139.01 11.3 2.62 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 -178.487 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 62.21 26.66 67.98 Favored Glycine 0 C--N 1.353 1.512 0 N-CA-C 114.0 0.36 . . . . 0.0 114.0 -179.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.442 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 85.5 mttt -103.66 -168.89 1.56 Allowed 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.373 0.669 . . . . 0.0 110.853 -179.251 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 1.8 tmt_? -96.98 159.56 14.84 Favored 'General case' 0 CA--C 1.559 1.322 0 C-N-CA 124.796 1.239 . . . . 0.0 107.718 176.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 9.1 mm -96.25 134.21 34.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 171.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.1 m -61.73 143.64 55.89 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.476 0.711 . . . . 0.0 110.314 177.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -66.25 -38.08 87.0 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 118.104 0.411 . . . . 0.0 110.724 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -57.76 -40.1 78.95 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.489 0.715 . . . . 0.0 110.786 173.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.536 ' HG3' HG21 ' A' ' 102' ' ' THR . 25.2 tpt180 -66.32 -42.28 88.43 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.427 176.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 83.9 mt -68.93 -38.15 79.34 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.784 0.834 . . . . 0.0 112.628 -176.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -78.67 -32.16 47.04 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 122.399 0.28 . . . . 0.0 110.339 -176.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.65 -38.14 65.07 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.469 0.708 . . . . 0.0 110.749 176.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 1.7 p -155.61 99.52 2.25 Favored Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 124.773 1.229 . . . . 0.0 108.911 -178.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -73.02 -15.88 25.83 Favored 'Trans proline' 0 C--N 1.371 1.73 0 C-N-CA 122.445 2.096 . . . . 0.0 113.173 176.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 19.5 p90 -95.0 64.68 2.83 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 122.251 1.025 . . . . 0.0 109.333 179.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.536 HG21 ' HG3' ' A' ' 95' ' ' ARG . 13.5 t -137.94 108.53 8.32 Favored Pre-proline 0 CA--C 1.559 1.315 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.061 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.28 -8.03 18.34 Favored 'Trans proline' 0 C--N 1.371 1.757 0 C-N-CA 122.668 2.245 . . . . 0.0 112.056 169.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -104.68 140.22 38.37 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.06 0.944 . . . . 0.0 109.558 -178.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.419 ' HB3' ' HB2' ' A' ' 84' ' ' CYS . 30.3 p -78.06 169.89 17.51 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 174.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -52.67 -37.72 59.22 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 123.518 0.727 . . . . 0.0 111.067 -178.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.403 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 24.0 mt-10 -57.85 -54.56 45.58 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.316 174.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 93.2 m -70.25 -26.82 64.01 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.387 -174.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.61 -44.05 87.76 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.78 0.832 . . . . 0.0 110.151 174.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -74.48 -20.1 60.13 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.439 177.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -95.32 3.88 54.0 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.107 0.963 . . . . 0.0 112.578 -177.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 92.4 mt . . . . . 0 N--CA 1.484 1.235 0 CA-C-O 119.228 -0.415 . . . . 0.0 110.664 178.279 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.496 HD11 HG23 ' A' ' 76' ' ' ILE . 2.5 tm? . . . . . 0 N--CA 1.484 1.242 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 64.94 176.81 0.2 Allowed 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 125.097 1.359 . . . . 0.0 112.613 -178.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 73.49 -81.55 0.72 Allowed Glycine 0 C--N 1.341 0.857 0 N-CA-C 110.562 -1.015 . . . . 0.0 110.562 -171.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 70.53 -80.58 0.41 Allowed Glycine 0 C--N 1.351 1.392 0 CA-C-O 119.743 -0.476 . . . . 0.0 113.375 174.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 68.52 135.26 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 126.161 1.784 . . . . 0.0 111.268 -171.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 30.7 p -73.58 92.39 1.92 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 123.369 0.667 . . . . 0.0 109.819 176.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' MET . . . . . 0.494 ' HB3' HG22 ' A' ' 9' ' ' VAL . 34.7 ttm -152.26 11.84 0.55 Allowed 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.341 1.056 . . . . 0.0 109.306 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.8 m120 63.79 33.21 12.98 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 124.101 0.961 . . . . 0.0 110.166 -170.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.494 HG22 ' HB3' ' A' ' 7' ' ' MET . 72.7 t -60.55 -37.58 75.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 123.95 0.9 . . . . 0.0 111.435 -178.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -69.27 -31.84 70.63 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.142 0.577 . . . . 0.0 111.008 -179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.3 m -66.71 -39.67 88.12 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.224 0.609 . . . . 0.0 109.974 174.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -70.23 -37.57 75.01 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.257 176.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -60.4 -53.57 56.01 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.533 1.133 . . . . 0.0 110.25 -175.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -64.75 -45.04 88.14 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.758 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.441 ' O ' ' HB2' ' A' ' 19' ' ' ARG . 10.9 tt -66.11 -32.37 57.84 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.263 0 N-CA-C 110.28 -0.267 . . . . 0.0 110.28 -174.401 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.58 ' HB3' HG21 ' A' ' 69' ' ' ILE . 69.7 mt -73.27 -38.05 66.07 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.019 0.928 . . . . 0.0 111.136 177.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.597 ' HE ' HD11 ' A' ' 73' ' ' LEU . 15.2 mmt85 -64.49 -41.96 96.15 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.52 0.728 . . . . 0.0 111.109 175.267 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -69.13 -35.92 76.92 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 15' ' ' ILE . 8.4 tpt180 -65.99 -48.96 69.47 Favored 'General case' 0 C--N 1.346 0.448 0 CA-C-N 114.341 -1.3 . . . . 0.0 110.799 -177.294 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.606 ' HB3' HG23 ' A' ' 69' ' ' ILE . 2.8 pt20 -70.76 -33.83 71.2 Favored 'General case' 0 C--O 1.216 -0.696 0 CA-C-O 118.947 -0.549 . . . . 0.0 110.96 -174.194 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.447 ' HG2' ' O ' ' A' ' 17' ' ' ARG . 32.5 mmt180 -76.4 -38.39 55.72 Favored 'General case' 0 C--N 1.362 1.144 0 O-C-N 123.456 0.473 . . . . 0.0 111.951 -176.084 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -67.43 -40.72 85.48 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 177.14 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.551 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 97.1 mt -69.73 -36.25 75.69 Favored 'General case' 0 C--N 1.346 0.442 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.505 175.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.449 ' HB2' ' O ' ' A' ' 20' ' ' GLN . 0.2 OUTLIER -58.61 -54.74 43.63 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.84 0.856 . . . . 0.0 110.318 -178.02 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.431 HH22 ' H ' ' A' ' 44' ' ' ASP . 6.9 ptm180 -69.11 -28.03 66.11 Favored 'General case' 0 CA--C 1.551 1.005 0 O-C-N 124.071 0.857 . . . . 0.0 110.815 -177.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 50.5 ttt85 -61.96 -55.04 33.49 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.826 0.85 . . . . 0.0 111.257 174.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.669 ' HB2' ' HA ' ' A' ' 58' ' ' LEU . 3.2 pp -82.51 -9.0 59.6 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 122.791 0.436 . . . . 0.0 111.904 -178.092 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 11.6 m170 -102.71 35.85 2.36 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.987 0.915 . . . . 0.0 109.017 171.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -58.27 -27.42 64.01 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.804 1.242 . . . . 0.0 112.578 175.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.456 HG21 HD22 ' A' ' 55' ' ' LEU . 0.2 OUTLIER -65.08 -34.27 69.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.444 0.698 . . . . 0.0 112.136 178.86 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -104.13 -12.51 16.69 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.591 0.756 . . . . 0.0 110.864 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -133.19 69.99 1.47 Allowed 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.965 0.906 . . . . 0.0 109.216 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -94.78 111.92 23.68 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 114.609 -1.178 . . . . 0.0 109.91 -178.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -103.43 102.51 12.43 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.412 0.685 . . . . 0.0 109.553 178.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -68.26 -45.95 71.76 Favored 'General case' 0 N--CA 1.481 1.122 0 CA-C-O 121.713 0.768 . . . . 0.0 109.459 173.117 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.408 ' HB3' ' HD2' ' A' ' 37' ' ' PRO . 38.2 mt-10 -72.27 171.82 8.81 Favored Pre-proline 0 CA--C 1.557 1.227 0 CA-C-N 113.603 -1.635 . . . . 0.0 110.45 177.389 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.408 ' HD2' ' HB3' ' A' ' 36' ' ' GLU . 12.2 Cg_endo -53.86 145.65 49.91 Favored 'Trans proline' 0 C--N 1.387 2.582 0 C-N-CA 122.267 1.978 . . . . 0.0 112.13 172.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 49.9 mtp180 -62.46 -26.83 68.73 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.621 -178.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 71.64 140.71 0.08 OUTLIER Pre-proline 0 CA--C 1.552 1.032 0 C-N-CA 125.733 1.613 . . . . 0.0 111.133 -178.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_endo -77.75 9.86 2.8 Favored 'Trans proline' 0 C--N 1.377 2.057 0 C-N-CA 122.823 2.349 . . . . 0.0 112.894 -178.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -112.6 150.58 31.19 Favored 'General case' 0 C--O 1.242 0.709 0 C-N-CA 124.528 1.131 . . . . 0.0 109.303 177.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -74.18 123.26 24.15 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.516 178.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -70.28 -48.94 54.53 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.063 0.945 . . . . 0.0 110.218 176.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.431 ' H ' HH22 ' A' ' 25' ' ' ARG . 20.2 t70 -164.63 134.51 3.86 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 114.72 -1.127 . . . . 0.0 108.434 -177.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 78.2 ttt180 -59.08 -47.62 84.59 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.252 1.021 . . . . 0.0 112.106 -173.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -164.45 129.88 2.81 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.161 0.584 . . . . 0.0 110.018 -177.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.6 t -79.98 175.92 10.2 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.01 0.524 . . . . 0.0 109.733 172.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.458 ' HG2' ' HD2' ' A' ' 49' ' ' ARG . 20.1 tt0 -66.2 -89.54 0.01 OUTLIER 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 123.031 0.532 . . . . 0.0 110.068 -179.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.458 ' HD2' ' HG2' ' A' ' 48' ' ' GLU . 2.8 mpt_? -145.0 -64.79 0.34 Allowed 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 174.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.7 m 62.37 -69.95 0.06 Allowed 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.628 1.571 . . . . 0.0 112.338 -178.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -70.59 86.19 0.64 Allowed 'General case' 0 CA--C 1.55 0.956 0 CA-C-O 121.398 0.618 . . . . 0.0 109.412 172.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -79.23 -27.38 42.44 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.739 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -78.0 178.24 7.65 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.142 0.977 . . . . 0.0 111.612 179.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 85.0 t -73.97 -67.59 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 173.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.456 HD22 HG21 ' A' ' 30' ' ' ILE . 33.4 tp 65.48 135.68 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 125.502 1.521 . . . . 0.0 112.924 178.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -65.52 -24.13 67.05 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.863 0.865 . . . . 0.0 112.42 -176.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -65.68 -21.7 66.57 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.245 0.618 . . . . 0.0 111.783 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.669 ' HA ' ' HB2' ' A' ' 27' ' ' LEU . 6.8 mp -83.09 109.78 17.44 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.276 -0.875 . . . . 0.0 109.021 168.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -77.97 149.25 34.21 Favored Glycine 0 C--N 1.346 1.117 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.784 -175.256 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -57.18 -49.35 76.25 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.551 1.141 . . . . 0.0 112.521 -175.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 9.8 p -61.06 -38.0 78.6 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.772 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.51 -51.38 31.68 Favored Glycine 0 C--N 1.348 1.23 0 O-C-N 123.704 0.628 . . . . 0.0 112.497 -179.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -64.1 -47.39 80.21 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.564 0.746 . . . . 0.0 111.235 -175.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.25 -22.86 59.14 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.751 -177.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -74.51 -44.81 49.55 Favored 'General case' 0 C--O 1.209 -1.035 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 173.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.426 HD11 ' HB2' ' A' ' 23' ' ' LEU . 5.1 mp -55.74 -43.24 76.44 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 124.122 0.969 . . . . 0.0 110.72 173.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 55.7 ttt180 -57.77 -45.93 85.28 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.252 1.021 . . . . 0.0 110.898 176.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -73.74 -33.47 64.34 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.438 -179.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.606 HG23 ' HB3' ' A' ' 20' ' ' GLN . 66.7 mt -69.18 -51.22 45.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.127 0.971 . . . . 0.0 109.226 -178.734 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -65.88 -27.04 67.92 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.182 0.993 . . . . 0.0 111.736 177.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.73 -42.82 81.26 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 122.792 0.437 . . . . 0.0 109.969 172.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.443 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -69.39 -39.71 77.82 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.773 0.829 . . . . 0.0 111.374 179.033 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.597 HD11 ' HE ' ' A' ' 17' ' ' ARG . 89.7 mt -72.68 -29.01 63.05 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.153 0.981 . . . . 0.0 110.939 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.36 -35.38 75.8 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.488 0.715 . . . . 0.0 110.164 173.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 67.2 mtm180 -64.32 -44.73 90.65 Favored 'General case' 0 C--N 1.355 0.846 0 O-C-N 123.6 0.563 . . . . 0.0 110.483 173.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.539 HD13 HD22 ' A' ' 73' ' ' LEU . 63.5 mt -63.35 -45.71 97.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 -179.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.78 -29.33 70.55 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.289 1.036 . . . . 0.0 111.717 179.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.504 ' HB3' HG22 ' A' ' 80' ' ' THR . 33.5 t -88.57 -12.3 43.1 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 123.964 0.906 . . . . 0.0 111.222 177.609 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 73.58 25.67 71.76 Favored Glycine 0 C--N 1.352 1.464 0 CA-C-N 116.768 -0.197 . . . . 0.0 112.868 -177.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.504 HG22 ' HB3' ' A' ' 78' ' ' SER . 14.7 t -123.62 25.82 8.01 Favored 'General case' 0 CA--C 1.556 1.209 0 C-N-CA 124.668 1.187 . . . . 0.0 110.375 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -66.18 140.87 58.22 Favored 'General case' 0 N--CA 1.477 0.913 0 O-C-N 121.538 -0.726 . . . . 0.0 110.232 171.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.474 ' HA3' ' HE1' ' A' ' 7' ' ' MET . . . 83.63 27.6 38.28 Favored Glycine 0 C--N 1.342 0.906 0 O-C-N 123.732 0.645 . . . . 0.0 111.52 -171.005 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 94.3 m -116.09 122.05 44.0 Favored 'General case' 0 C--O 1.242 0.708 0 C-N-CA 123.656 0.783 . . . . 0.0 110.182 175.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 13.1 t -66.51 95.96 0.35 Allowed 'General case' 0 C--N 1.348 0.528 0 C-N-CA 124.31 1.044 . . . . 0.0 108.623 173.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 11.8 m -63.29 -29.84 48.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 C-N-CA 123.991 0.916 . . . . 0.0 112.075 -170.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -72.09 -21.01 61.56 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.357 1.063 . . . . 0.0 111.081 -179.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 6.5 m -119.63 -16.74 8.79 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.752 0.821 . . . . 0.0 112.276 -169.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 56.95 47.68 85.06 Favored Glycine 0 C--N 1.355 1.591 0 N-CA-C 111.316 -0.714 . . . . 0.0 111.316 -166.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -138.84 -157.58 0.78 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.572 1.149 . . . . 0.0 110.116 -171.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 11.4 tpt180 -97.64 145.78 25.96 Favored 'General case' 0 CA--C 1.564 1.485 0 C-N-CA 124.083 0.953 . . . . 0.0 112.47 -176.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 5.4 mm -95.01 148.77 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 164.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.8 m -75.44 144.54 42.1 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 174.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -61.67 -37.64 84.83 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.082 0.553 . . . . 0.0 110.326 175.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -62.15 -38.43 88.98 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.942 0.897 . . . . 0.0 111.378 177.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.443 ' HG3' HG22 ' A' ' 102' ' ' THR . 30.3 tpt180 -64.28 -40.51 96.12 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.413 175.492 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 97.3 mt -78.15 -32.38 50.24 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 -175.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -76.11 -28.18 57.39 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -77.64 -49.56 14.29 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.538 0.735 . . . . 0.0 110.421 173.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.2 p -144.86 96.59 5.04 Favored Pre-proline 0 CA--C 1.558 1.251 0 C-N-CA 124.703 1.201 . . . . 0.0 109.139 -178.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . 0.45 ' HG2' HD21 ' A' ' 16' ' ' LEU . 55.5 Cg_endo -73.45 -23.57 17.25 Favored 'Trans proline' 0 C--N 1.378 2.123 0 C-N-CA 122.542 2.162 . . . . 0.0 113.569 -179.056 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 46.5 p90 -81.95 -2.26 50.8 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -177.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.443 HG22 ' HG3' ' A' ' 95' ' ' ARG . 13.8 t -68.77 122.4 84.75 Favored Pre-proline 0 CA--C 1.558 1.279 0 CA-C-N 118.373 0.533 . . . . 0.0 110.708 -179.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.39 -27.72 18.95 Favored 'Trans proline' 0 C--N 1.371 1.735 0 C-N-CA 122.199 1.933 . . . . 0.0 111.782 173.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -104.44 152.18 22.63 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.628 0.771 . . . . 0.0 110.735 -174.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.524 ' SG ' ' HB2' ' A' ' 108' ' ' CYS . 30.7 p -72.3 157.47 37.62 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 115.138 -0.937 . . . . 0.0 108.794 170.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.412 ' HB2' ' HD3' ' A' ' 95' ' ' ARG . 33.5 tt0 -51.1 -39.76 56.89 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.279 1.031 . . . . 0.0 112.16 -179.3 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -66.9 -48.32 69.08 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 124.182 0.993 . . . . 0.0 109.777 -177.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.524 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 85.0 m -82.54 -16.01 50.21 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 114.682 -1.145 . . . . 0.0 112.566 -174.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -85.23 -26.07 26.92 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.52 0.728 . . . . 0.0 109.942 171.249 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -77.59 -23.62 49.9 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.762 0.825 . . . . 0.0 110.175 170.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -72.91 -11.5 60.61 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.797 0.839 . . . . 0.0 111.738 174.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 69.9 mt . . . . . 0 CA--C 1.553 1.091 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 172.043 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.564 ' H2 ' HD12 ' A' ' 1' ' ' LEU . 4.7 mp . . . . . 0 N--CA 1.483 1.202 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -160.67 139.21 10.08 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.49 0.716 . . . . 0.0 110.141 -177.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -90.57 10.54 74.28 Favored Glycine 0 C--N 1.343 0.933 0 O-C-N 123.573 0.546 . . . . 0.0 113.391 178.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 85.28 -63.78 4.29 Favored Glycine 0 C--N 1.351 1.391 0 C-N-CA 122.964 0.316 . . . . 0.0 113.268 176.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -140.94 -170.24 3.0 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.843 0.857 . . . . 0.0 110.648 -173.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.8 t 67.95 -176.04 0.2 Allowed 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 124.579 1.152 . . . . 0.0 110.043 -175.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' MET . . . . . 0.461 ' SD ' HD13 ' A' ' 96' ' ' LEU . 49.1 ttp -73.07 79.65 1.22 Allowed 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 175.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -77.3 110.28 11.9 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.502 -170.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 55.4 t -66.54 -28.31 42.95 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 C-N-CA 123.408 0.683 . . . . 0.0 110.595 175.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -65.92 -38.9 89.88 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.968 0.907 . . . . 0.0 112.604 -176.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 60.3 p -64.48 -39.76 94.41 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 174.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -68.93 -32.56 72.26 Favored 'General case' 0 C--O 1.215 -0.74 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.184 177.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.525 ' HG2' HG23 ' A' ' 76' ' ' ILE . 1.4 tm-20 -60.31 -59.3 5.63 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.355 1.062 . . . . 0.0 109.374 -177.309 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt -66.81 -39.67 87.81 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 114.623 -1.171 . . . . 0.0 112.339 -174.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.455 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 12.5 tt -66.99 -38.43 81.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 -177.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.571 ' HB3' HG23 ' A' ' 69' ' ' ILE . 66.0 mt -67.84 -39.03 83.9 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 122.986 0.514 . . . . 0.0 111.368 178.714 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.436 ' O ' ' HG2' ' A' ' 21' ' ' ARG . 38.3 mmt180 -61.93 -48.16 81.66 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.123 0.569 . . . . 0.0 110.439 178.165 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -62.48 -40.9 98.18 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.261 0.624 . . . . 0.0 110.78 178.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.471 ' HA ' ' HG2' ' A' ' 22' ' ' GLU . 6.3 mpt_? -72.02 -38.1 69.65 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.77 0.828 . . . . 0.0 112.151 -176.423 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.479 ' HB3' HG22 ' A' ' 69' ' ' ILE . 2.5 pt20 -68.56 -33.88 74.85 Favored 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.148 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.521 ' HG3' ' H ' ' A' ' 47' ' ' SER . 24.8 mmt180 -77.8 -30.3 51.21 Favored 'General case' 0 C--N 1.349 0.571 0 CA-C-O 118.972 -0.537 . . . . 0.0 112.159 -178.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.471 ' HG2' ' HA ' ' A' ' 19' ' ' ARG . 5.4 pt-20 -70.2 -33.82 72.17 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 174.692 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.561 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 88.1 mt -69.25 -47.58 64.28 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.404 172.315 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.458 ' O ' ' HB2' ' A' ' 28' ' ' HIS . 1.7 m-85 -56.88 -46.61 81.74 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.909 0.883 . . . . 0.0 111.137 -175.708 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.8 ptp180 -68.02 -37.0 80.89 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 122.96 0.504 . . . . 0.0 111.031 177.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.54 HH11 HD22 ' A' ' 23' ' ' LEU . 41.4 ttm180 -62.8 -43.08 99.73 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.037 0.935 . . . . 0.0 112.472 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 1.5 pp -94.67 -15.74 23.7 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.545 0.338 . . . . 0.0 111.836 -177.661 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.458 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 10.1 m170 -103.03 30.45 4.81 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 123.386 0.674 . . . . 0.0 109.434 168.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.444 ' HZ1' HD13 ' A' ' 30' ' ' ILE . 0.0 OUTLIER -52.21 -19.91 2.3 Favored 'General case' 0 N--CA 1.496 1.827 0 C-N-CA 126.093 1.757 . . . . 0.0 114.887 179.555 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.521 HD12 ' H ' ' A' ' 30' ' ' ILE . 0.1 OUTLIER -84.59 -30.44 7.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 123.968 0.907 . . . . 0.0 111.238 -175.489 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -101.06 -30.31 11.67 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.25 0.62 . . . . 0.0 110.372 176.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -103.99 118.64 37.16 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.325 1.05 . . . . 0.0 108.176 -178.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -59.88 -28.83 67.88 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.383 0.673 . . . . 0.0 111.978 -175.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -77.62 81.69 4.06 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 123.342 0.657 . . . . 0.0 110.432 177.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -70.55 -47.72 58.95 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 168.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -86.72 126.19 64.57 Favored Pre-proline 0 CA--C 1.546 0.822 0 CA-C-N 113.736 -1.575 . . . . 0.0 108.208 169.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -58.45 102.9 0.14 Allowed 'Trans proline' 0 C--N 1.373 1.838 0 C-N-CA 122.848 2.365 . . . . 0.0 111.283 171.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 27.9 mmm180 -82.73 66.2 8.23 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 122.249 1.023 . . . . 0.0 109.972 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -160.86 106.32 1.28 Allowed Pre-proline 0 CA--C 1.549 0.915 0 CA-C-N 113.237 -1.802 . . . . 0.0 106.488 178.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -80.17 16.68 1.46 Allowed 'Trans proline' 0 C--N 1.374 1.889 0 C-N-CA 122.959 2.439 . . . . 0.0 113.452 -176.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -156.66 165.7 35.51 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.132 0.973 . . . . 0.0 108.721 -175.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -77.09 63.91 2.45 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 122.227 1.013 . . . . 0.0 109.385 167.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -65.88 -17.84 64.92 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-N 114.437 -1.256 . . . . 0.0 110.05 -176.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.7 t70 67.66 72.83 0.32 Allowed 'General case' 0 C--N 1.359 1.008 0 C-N-CA 125.123 1.369 . . . . 0.0 109.487 175.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 15.9 mmt180 -77.58 -44.57 28.0 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-N 113.984 -1.462 . . . . 0.0 109.693 173.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 47.31 65.4 1.27 Allowed 'General case' 0 C--N 1.364 1.209 0 O-C-N 124.858 1.349 . . . . 0.0 111.019 179.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.521 ' H ' ' HG3' ' A' ' 21' ' ' ARG . 14.5 m -57.62 123.1 14.45 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 114.533 -1.212 . . . . 0.0 111.823 -172.072 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.489 ' HB3' HH11 ' A' ' 49' ' ' ARG . 11.9 tp10 -72.76 170.76 13.94 Favored 'General case' 0 CA--C 1.555 1.165 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 173.671 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.489 HH11 ' HB3' ' A' ' 48' ' ' GLU . 6.9 mpt_? 69.14 78.79 0.21 Allowed 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.032 1.333 . . . . 0.0 108.892 -175.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.5 m -72.16 135.85 46.28 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.786 177.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 20.5 m120 -74.24 116.14 14.55 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 122.965 0.506 . . . . 0.0 111.008 -176.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -74.56 -39.09 62.49 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.661 0.784 . . . . 0.0 109.888 175.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -74.94 116.47 15.71 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.386 177.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 92.2 t -70.71 -53.81 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 123.101 0.56 . . . . 0.0 110.03 179.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 55.0 tp 70.81 137.52 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 124.905 1.282 . . . . 0.0 111.198 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -70.87 -18.16 62.7 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 123.401 0.68 . . . . 0.0 112.651 -171.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -79.62 25.56 0.33 Allowed 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 -170.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.2 mt -96.01 145.4 25.47 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 122.112 -0.368 . . . . 0.0 110.033 -178.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -79.18 151.17 34.62 Favored Glycine 0 C--N 1.348 1.242 0 CA-C-O 119.27 -0.739 . . . . 0.0 111.423 172.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -62.43 -51.67 66.62 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.26 0.624 . . . . 0.0 111.594 -176.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 8.4 p -60.74 -32.53 52.16 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 123.651 0.78 . . . . 0.0 111.21 175.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.518 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -60.5 -57.0 21.22 Favored Glycine 0 C--N 1.349 1.304 0 O-C-N 123.992 0.807 . . . . 0.0 111.439 175.542 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -63.41 -38.89 92.9 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 124.636 1.174 . . . . 0.0 111.473 -178.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -62.13 -53.25 57.98 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-N 114.85 -1.068 . . . . 0.0 109.66 -175.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -70.75 -34.23 71.64 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-N 114.044 -1.435 . . . . 0.0 109.874 -179.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' A' ' 62' ' ' GLY . 14.8 tp -60.71 -53.51 56.58 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.699 1.2 . . . . 0.0 111.001 -178.121 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 80.5 ttt180 -76.16 -29.75 57.84 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 113.742 -1.572 . . . . 0.0 110.171 -173.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.4 -47.11 80.42 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.17 0.588 . . . . 0.0 110.263 173.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.571 HG23 ' HB3' ' A' ' 16' ' ' LEU . 74.7 mt -62.34 -48.19 89.51 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.661 175.444 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -68.8 -33.29 73.61 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.358 0.663 . . . . 0.0 110.374 -172.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.9 -41.45 74.69 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.382 0.673 . . . . 0.0 109.979 175.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.473 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -61.63 -41.44 97.48 Favored 'General case' 0 N--CA 1.481 1.115 0 O-C-N 123.882 0.739 . . . . 0.0 110.948 177.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.493 HD22 HD13 ' A' ' 76' ' ' ILE . 92.5 mt -67.93 -38.1 82.46 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.695 1.198 . . . . 0.0 111.53 177.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.67 -31.68 72.82 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.707 175.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -75.12 -33.64 61.59 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.748 0.819 . . . . 0.0 111.108 176.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.525 HG23 ' HG2' ' A' ' 13' ' ' GLU . 73.0 mt -63.33 -43.04 98.41 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 174.135 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.87 -41.02 99.23 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.166 175.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.431 ' HB3' HG23 ' A' ' 80' ' ' THR . 27.2 t -83.12 -6.64 59.56 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.86 0.864 . . . . 0.0 112.095 -175.075 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.63 26.19 73.55 Favored Glycine 0 C--N 1.354 1.569 0 CA-C-O 120.962 0.201 . . . . 0.0 112.814 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.431 HG23 ' HB3' ' A' ' 78' ' ' SER . 12.4 t -130.67 27.07 4.99 Favored 'General case' 0 CA--C 1.555 1.165 0 C-N-CA 124.59 1.156 . . . . 0.0 110.417 179.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -66.17 146.21 54.9 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 166.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.533 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 73.16 33.57 59.13 Favored Glycine 0 C--O 1.216 -0.998 0 O-C-N 123.667 0.604 . . . . 0.0 111.74 -174.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 88.2 m -122.09 146.69 46.96 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.337 0.655 . . . . 0.0 109.926 176.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 41.2 t -115.47 102.17 9.57 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.738 1.215 . . . . 0.0 109.082 176.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 27.3 m -65.49 -24.96 35.74 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 C-N-CA 123.887 0.875 . . . . 0.0 113.07 -174.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.54 ' HD2' ' HB3' ' A' ' 108' ' ' CYS . 22.0 ttmm -74.46 -11.05 60.13 Favored 'General case' 0 CA--C 1.559 1.312 0 C-N-CA 123.097 0.559 . . . . 0.0 112.249 -177.032 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 28.0 p -138.92 1.85 2.1 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.882 -0.511 . . . . 0.0 111.722 171.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 59.67 31.84 72.32 Favored Glycine 0 C--N 1.356 1.66 0 O-C-N 123.526 0.517 . . . . 0.0 114.179 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 50.4 mtpt -123.88 166.39 15.74 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-N 117.105 0.452 . . . . 0.0 111.215 -174.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.533 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 14.1 tpp180 -69.42 140.57 54.14 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 124.5 1.12 . . . . 0.0 110.876 -179.376 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 17.0 mm -75.54 150.67 6.6 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 123.762 0.825 . . . . 0.0 109.058 171.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 44.3 m -70.53 145.67 50.69 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 122.873 0.469 . . . . 0.0 109.769 173.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -58.75 -40.52 84.12 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.716 0.406 . . . . 0.0 110.05 174.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.495 ' HA ' ' HE3' ' A' ' 97' ' ' LYS . 36.4 m-20 -64.59 -32.9 74.75 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 114.964 -1.016 . . . . 0.0 111.454 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 4.8 tpm_? -70.72 -40.35 72.85 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.468 176.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.461 HD13 ' SD ' ' A' ' 7' ' ' MET . 98.8 mt -72.39 -35.73 68.5 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 123.598 0.561 . . . . 0.0 111.932 -177.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.495 ' HE3' ' HA ' ' A' ' 94' ' ' ASP . 15.7 ptpt -74.86 -29.72 61.11 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -77.79 -39.58 43.5 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.585 0.754 . . . . 0.0 111.099 176.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.5 p -157.37 96.27 2.06 Favored Pre-proline 0 CA--C 1.557 1.216 0 C-N-CA 124.53 1.132 . . . . 0.0 109.15 -177.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . 0.465 ' HG2' HD22 ' A' ' 16' ' ' LEU . 89.3 Cg_endo -78.53 -1.15 11.35 Favored 'Trans proline' 0 C--N 1.378 2.118 0 C-N-CA 122.796 2.331 . . . . 0.0 113.467 -179.454 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 27.1 p90 -108.6 9.81 27.19 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -178.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 12.7 t -76.78 118.47 71.96 Favored Pre-proline 0 CA--C 1.561 1.401 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 175.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -76.75 -6.34 16.78 Favored 'Trans proline' 0 C--N 1.376 1.977 0 C-N-CA 122.552 2.168 . . . . 0.0 112.377 178.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.497 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 33.0 m-85 -130.19 159.03 38.08 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.663 0.785 . . . . 0.0 109.899 -177.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 17.8 p -82.38 165.03 20.65 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 176.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.5 tm0? -49.19 -40.33 32.88 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.597 0.759 . . . . 0.0 111.712 -173.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -56.97 -54.23 49.0 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.643 0.777 . . . . 0.0 111.632 177.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.54 ' HB3' ' HD2' ' A' ' 86' ' ' LYS . 61.8 m -78.74 -22.14 46.96 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.56 -173.313 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -81.27 -33.05 32.95 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.789 0.835 . . . . 0.0 109.998 179.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -78.78 -20.26 50.26 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.674 0.79 . . . . 0.0 110.655 173.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -79.73 -17.43 53.57 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.669 0.787 . . . . 0.0 112.165 176.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 95.9 mt . . . . . 0 CA--C 1.554 1.127 0 CA-C-O 118.755 -0.64 . . . . 0.0 110.674 179.767 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 84.7 mt . . . . . 0 N--CA 1.48 1.053 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -162.88 98.68 0.97 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.509 0.724 . . . . 0.0 110.004 178.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -88.28 65.07 3.46 Favored Glycine 0 C--N 1.346 1.118 0 N-CA-C 111.533 -0.627 . . . . 0.0 111.533 176.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -141.61 110.13 0.62 Allowed Glycine 0 C--N 1.347 1.158 0 N-CA-C 111.815 -0.514 . . . . 0.0 111.815 -176.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -94.08 -24.08 17.72 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.531 0.732 . . . . 0.0 110.399 177.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 50.6 m -112.7 172.46 6.91 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.657 1.183 . . . . 0.0 109.374 173.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 13.5 ptm 48.17 37.83 8.84 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 125.853 1.661 . . . . 0.0 110.824 -173.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -50.13 101.15 0.03 OUTLIER 'General case' 0 C--N 1.364 1.213 0 CA-C-N 114.051 -1.431 . . . . 0.0 111.591 -169.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 59.1 t -56.67 -28.2 27.12 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.318 0 CA-C-N 114.174 -1.375 . . . . 0.0 112.028 -173.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.8 mp0 -62.85 -43.69 98.13 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 124.75 1.22 . . . . 0.0 111.117 -174.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.9 m -61.28 -44.91 96.46 Favored 'General case' 0 C--O 1.241 0.64 0 CA-C-N 114.757 -1.111 . . . . 0.0 109.936 175.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.464 ' HA ' HG21 ' A' ' 15' ' ' ILE . 27.8 m-85 -72.83 -29.99 63.67 Favored 'General case' 0 C--O 1.215 -0.733 0 CA-C-N 114.84 -1.073 . . . . 0.0 111.332 -178.268 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.447 ' HG2' HG23 ' A' ' 76' ' ' ILE . 3.4 tm-20 -65.42 -53.07 48.38 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 125.001 1.32 . . . . 0.0 109.002 -174.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.6 ptmm? -67.32 -43.17 82.29 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 114.81 -1.087 . . . . 0.0 111.603 -179.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.464 HG21 ' HA ' ' A' ' 12' ' ' TYR . 13.2 tt -69.54 -29.45 41.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 CA-C-O 120.779 0.324 . . . . 0.0 110.891 -174.199 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.448 ' HB3' HG22 ' A' ' 69' ' ' ILE . 41.0 mt -64.15 -46.65 83.12 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.736 171.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -64.25 -38.69 91.94 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 123.424 0.453 . . . . 0.0 111.274 178.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -58.66 -51.47 69.78 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.101 0.56 . . . . 0.0 109.661 177.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -64.53 -40.22 95.21 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 124.267 0.979 . . . . 0.0 111.189 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.449 ' HB2' HG21 ' A' ' 69' ' ' ILE . 3.9 tt0 -66.11 -44.62 83.78 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.268 0.627 . . . . 0.0 111.368 -179.109 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.507 ' O ' ' HG2' ' A' ' 25' ' ' ARG . 17.9 mmt180 -76.22 -36.0 58.78 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 119.101 -0.476 . . . . 0.0 111.07 -172.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -68.57 -38.45 80.73 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 123.684 0.615 . . . . 0.0 110.144 175.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.41 HD21 ' HA2' ' A' ' 62' ' ' GLY . 67.2 mt -67.18 -40.61 86.59 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 122.786 0.435 . . . . 0.0 110.674 175.018 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -55.41 -58.11 9.1 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 124.267 0.98 . . . . 0.0 109.964 -175.076 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.507 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 8.1 ptm180 -64.65 -34.73 78.97 Favored 'General case' 0 CA--C 1.559 1.316 0 O-C-N 124.036 0.835 . . . . 0.0 111.71 177.123 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -63.73 -41.22 98.08 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 123.784 0.834 . . . . 0.0 112.489 -178.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.659 HD23 HD21 ' A' ' 66' ' ' LEU . 4.3 pp -89.8 -23.7 21.66 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 122.88 0.472 . . . . 0.0 110.061 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 67.1 m-70 -86.18 32.91 0.61 Allowed 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.328 0.651 . . . . 0.0 109.99 167.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.8 pttp -58.96 -29.46 67.18 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 125.144 1.378 . . . . 0.0 111.925 174.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.42 ' H ' HD11 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -65.12 -34.67 72.16 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.055 0 C-N-CA 123.409 0.683 . . . . 0.0 111.107 173.775 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -85.48 -25.41 26.9 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.061 0.944 . . . . 0.0 110.411 178.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -79.08 99.6 7.0 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.269 -0.878 . . . . 0.0 109.376 176.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -58.66 -45.13 90.01 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.61 0.764 . . . . 0.0 110.607 175.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -82.69 157.7 23.22 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-N 114.166 -1.379 . . . . 0.0 110.57 -175.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -74.73 1.44 12.39 Favored 'General case' 0 N--CA 1.488 1.445 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.422 171.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.495 ' HB3' ' NH2' ' A' ' 25' ' ' ARG . 90.6 mt-10 79.2 154.22 0.13 Allowed Pre-proline 0 C--N 1.358 0.973 0 C-N-CA 125.874 1.669 . . . . 0.0 112.733 167.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -57.52 122.14 11.25 Favored 'Trans proline' 0 C--N 1.382 2.303 0 C-N-CA 122.914 2.409 . . . . 0.0 112.42 173.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 74.2 mtp85 -76.88 -29.15 55.65 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.136 0.574 . . . . 0.0 109.869 170.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -76.18 148.24 80.81 Favored Pre-proline 0 N--CA 1.477 0.889 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.049 170.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -61.44 99.65 0.17 Allowed 'Trans proline' 0 C--N 1.378 2.123 0 C-N-CA 122.458 2.105 . . . . 0.0 111.076 177.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -158.49 96.59 1.41 Allowed 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.831 -171.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -174.52 -57.91 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 125.419 1.488 . . . . 0.0 107.357 163.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 36.56 69.05 0.22 Allowed 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 126.456 1.902 . . . . 0.0 113.983 176.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.49 ' HB3' ' HD2' ' A' ' 21' ' ' ARG . 16.6 t70 -87.78 127.53 35.32 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 174.279 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -130.44 25.51 5.12 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 174.752 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -112.42 -61.5 1.72 Allowed 'General case' 0 C--N 1.353 0.718 0 C-N-CA 123.548 0.739 . . . . 0.0 111.857 -170.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 71.6 p -76.87 100.91 5.7 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 122.918 0.487 . . . . 0.0 111.812 -169.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -85.83 100.06 11.8 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 171.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 31.5 mmm180 -123.42 146.72 47.78 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.654 0.782 . . . . 0.0 110.077 -178.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 37.5 m -87.04 114.88 24.03 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.673 0.789 . . . . 0.0 109.432 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -87.3 100.17 12.51 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.992 0.917 . . . . 0.0 111.769 -174.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -144.09 15.57 1.71 Allowed 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.485 0.714 . . . . 0.0 111.608 -175.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.713 ' HB2' HD13 ' A' ' 58' ' ' LEU . 3.5 mp0 -57.94 119.16 6.25 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.367 0.667 . . . . 0.0 109.875 -175.719 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 22.9 t -72.14 -11.6 15.1 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 123.992 0.917 . . . . 0.0 111.65 -169.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 63.9 tp -54.49 123.84 14.29 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 123.612 0.765 . . . . 0.0 111.434 176.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -71.77 -17.0 62.21 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.564 0.745 . . . . 0.0 111.717 -177.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -79.9 13.18 2.3 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.247 0.619 . . . . 0.0 112.666 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.713 HD13 ' HB2' ' A' ' 53' ' ' GLU . 18.2 mt -89.15 132.11 34.97 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 161.026 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -64.08 129.84 38.26 Favored Glycine 0 C--N 1.347 1.161 0 CA-C-O 119.244 -0.753 . . . . 0.0 111.483 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -63.84 -40.82 97.49 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.853 0.861 . . . . 0.0 112.235 -175.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 62.3 t -57.53 -39.23 68.07 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 C-N-CA 123.688 0.795 . . . . 0.0 109.518 173.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.536 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -63.87 -57.36 14.37 Favored Glycine 0 C--N 1.344 1.021 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.427 177.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.422 ' NE2' ' HB2' ' A' ' 58' ' ' LEU . 98.2 mt-30 -58.48 -42.86 88.51 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 124.966 1.306 . . . . 0.0 112.109 -175.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -70.19 -50.9 35.47 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.24 -173.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -62.78 -37.58 87.25 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.421 178.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.659 HD21 HD23 ' A' ' 27' ' ' LEU . 10.4 tp -58.27 -49.53 76.79 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.951 1.301 . . . . 0.0 109.963 178.368 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -66.74 -33.83 76.5 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.925 -176.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.34 -35.02 75.49 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.522 0.729 . . . . 0.0 110.571 175.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.449 HG21 ' HB2' ' A' ' 20' ' ' GLN . 97.3 mt -68.36 -54.21 23.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 123.731 0.813 . . . . 0.0 110.314 176.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -59.53 -32.14 70.04 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 124.918 1.287 . . . . 0.0 112.11 178.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.467 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -65.14 -46.61 80.24 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.303 0.641 . . . . 0.0 109.647 174.142 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.463 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -69.01 -36.18 77.5 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.702 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.538 HD22 HD13 ' A' ' 76' ' ' ILE . 73.8 mt -71.2 -34.06 70.52 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 124.165 0.986 . . . . 0.0 110.163 177.605 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.85 -36.77 85.01 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.131 173.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.467 ' HG2' ' O ' ' A' ' 71' ' ' ALA . 4.9 mmp_? -67.5 -35.96 80.14 Favored 'General case' 0 C--O 1.216 -0.707 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.839 175.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.538 HD13 HD22 ' A' ' 73' ' ' LEU . 64.7 mt -68.47 -43.34 83.97 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 CA-C-O 121.031 0.443 . . . . 0.0 110.385 179.004 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.7 -28.71 68.65 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.22 177.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.5 t -87.54 -15.9 36.17 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.786 0.834 . . . . 0.0 111.321 175.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 82.22 5.64 89.46 Favored Glycine 0 C--N 1.35 1.333 0 C-N-CA 123.187 0.422 . . . . 0.0 113.992 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.44 HG23 ' HD3' ' A' ' 75' ' ' ARG . 13.3 t -109.89 30.07 7.04 Favored 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 124.369 1.067 . . . . 0.0 110.538 -177.053 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.455 ' HE1' ' HB3' ' A' ' 72' ' ' ALA . 79.7 t80 -63.99 147.68 51.46 Favored 'General case' 0 N--CA 1.479 0.981 0 O-C-N 121.958 -0.464 . . . . 0.0 111.38 171.054 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 71.07 42.57 58.71 Favored Glycine 0 C--N 1.347 1.184 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.263 -175.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 98.0 m -129.61 122.28 28.77 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.34 1.056 . . . . 0.0 110.152 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.452 ' HB2' ' HB3' ' A' ' 105' ' ' CYS . 47.3 t -76.49 100.12 5.15 Favored 'General case' 0 C--N 1.351 0.649 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 170.513 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 35.4 m -60.38 -29.06 43.51 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 O-C-N 124.318 1.011 . . . . 0.0 111.628 177.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.497 ' HD3' ' SG ' ' A' ' 108' ' ' CYS . 47.6 tttm -77.23 -6.28 52.48 Favored 'General case' 0 CA--C 1.56 1.351 0 C-N-CA 124.296 1.038 . . . . 0.0 111.665 -177.392 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 63.1 m -124.26 -33.96 2.99 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.981 0.913 . . . . 0.0 112.37 177.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 87.31 6.5 78.0 Favored Glycine 0 CA--C 1.537 1.415 0 N-CA-C 111.874 -0.49 . . . . 0.0 111.874 -160.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -96.34 -172.21 2.47 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.379 1.071 . . . . 0.0 111.233 -174.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 26.6 mmt85 -91.45 163.05 14.31 Favored 'General case' 0 C--O 1.244 0.791 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.467 169.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 20.1 mm -92.45 142.95 12.36 Favored 'Isoleucine or valine' 0 C--O 1.244 0.767 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 163.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 44.2 m -68.29 144.16 54.95 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 175.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -61.02 -36.45 79.55 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 122.625 0.37 . . . . 0.0 110.169 174.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -59.15 -40.88 86.92 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.304 1.042 . . . . 0.0 110.332 175.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -71.37 -38.16 71.57 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.559 177.056 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 73.2 mt -70.44 -35.42 73.36 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.613 0.765 . . . . 0.0 112.031 -177.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -79.24 -27.45 42.41 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -78.97 -27.88 43.54 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.004 0.922 . . . . 0.0 111.231 174.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.9 p -170.86 99.3 0.42 Allowed Pre-proline 0 CA--C 1.561 1.367 0 C-N-CA 124.937 1.295 . . . . 0.0 109.212 -178.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -75.55 -12.59 20.45 Favored 'Trans proline' 0 C--N 1.375 1.924 0 C-N-CA 122.366 2.044 . . . . 0.0 112.675 176.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 12.6 p90 -101.86 57.89 0.83 Allowed 'General case' 0 C--O 1.24 0.587 0 C-N-CA 124.215 1.006 . . . . 0.0 109.599 -179.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 11.9 t -131.88 117.26 16.09 Favored Pre-proline 0 CA--C 1.552 1.057 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.876 174.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -77.4 -4.77 15.05 Favored 'Trans proline' 0 C--N 1.375 1.923 0 C-N-CA 122.65 2.233 . . . . 0.0 112.134 171.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.42 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 16.2 m-85 -116.02 138.5 51.16 Favored 'General case' 0 C--N 1.353 0.753 0 C-N-CA 123.932 0.893 . . . . 0.0 110.369 -173.688 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.503 ' SG ' ' HB2' ' A' ' 107' ' ' GLU . 22.0 p -72.64 168.97 17.57 Favored 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 174.157 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -52.94 -37.75 61.27 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.802 0.841 . . . . 0.0 111.861 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.503 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 24.8 mt-10 -54.82 -53.47 54.77 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 124.211 1.004 . . . . 0.0 110.63 176.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.497 ' SG ' ' HD3' ' A' ' 86' ' ' LYS . 87.8 m -71.39 -38.59 71.48 Favored 'General case' 0 C--O 1.214 -0.775 0 CA-C-N 114.563 -1.199 . . . . 0.0 111.28 -176.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.95 -21.35 66.82 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.35 0.66 . . . . 0.0 111.216 176.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -85.07 -31.41 23.4 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.493 0.717 . . . . 0.0 111.291 172.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -133.31 81.48 1.93 Allowed 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.517 0.727 . . . . 0.0 111.28 -176.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 97.9 mt . . . . . 0 N--CA 1.484 1.233 0 C-N-CA 123.764 0.825 . . . . 0.0 109.383 171.876 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.499 ' H3 ' HD11 ' A' ' 1' ' ' LEU . 5.3 mp . . . . . 0 N--CA 1.484 1.241 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.407 ' HB1' ' HG ' ' A' ' 11' ' ' SER . . . -150.21 148.68 29.21 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.682 0.793 . . . . 0.0 109.913 179.48 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -174.72 -147.98 6.42 Favored Glycine 0 C--N 1.341 0.823 0 N-CA-C 111.772 -0.531 . . . . 0.0 111.772 -178.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.8 -26.08 72.27 Favored Glycine 0 C--N 1.351 1.377 0 C-N-CA 122.892 0.282 . . . . 0.0 113.32 -178.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -97.49 -67.81 0.83 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.648 0.779 . . . . 0.0 109.714 178.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 54.9 m -72.76 98.78 2.47 Favored 'General case' 0 C--N 1.349 0.552 0 C-N-CA 123.429 0.692 . . . . 0.0 110.04 -177.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 25.5 ptm -62.74 -40.05 96.01 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 123.205 0.602 . . . . 0.0 109.387 171.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.433 ' HB3' ' HG ' ' A' ' 11' ' ' SER . 65.3 t30 52.49 101.35 0.01 OUTLIER 'General case' 0 C--N 1.357 0.894 0 C-N-CA 126.24 1.816 . . . . 0.0 111.555 -178.697 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 39.8 t -61.32 -26.94 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.407 178.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -62.63 -40.54 97.3 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 124.305 1.042 . . . . 0.0 110.691 175.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.433 ' HG ' ' HB3' ' A' ' 8' ' ' ASN . 39.5 m -59.27 -44.18 92.46 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 121.052 0.453 . . . . 0.0 110.406 175.575 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -71.38 -32.5 68.54 Favored 'General case' 0 C--N 1.347 0.494 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.738 -179.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -62.49 -57.0 12.76 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.182 0.993 . . . . 0.0 109.292 -179.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 18.2 ptmt -66.76 -39.28 87.82 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 123.899 0.75 . . . . 0.0 112.404 -174.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 14.0 tt -63.37 -34.37 66.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 -179.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.523 ' HB3' HG23 ' A' ' 69' ' ' ILE . 80.4 mt -70.61 -33.67 71.29 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 122.927 0.491 . . . . 0.0 111.843 175.577 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.02 -46.24 85.35 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 122.964 0.505 . . . . 0.0 109.733 176.383 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -60.95 -49.94 75.43 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.775 0.83 . . . . 0.0 111.062 176.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.457 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 3.5 mpt_? -66.0 -37.3 85.57 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 115.168 -0.923 . . . . 0.0 111.778 -174.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.571 ' HB3' HG22 ' A' ' 69' ' ' ILE . 2.5 pt20 -70.72 -40.64 72.7 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 117.996 0.362 . . . . 0.0 110.389 -177.667 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.428 ' HD2' ' HD3' ' A' ' 45' ' ' ARG . 91.5 mtt-85 -79.39 -30.31 42.42 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 112.427 0.528 . . . . 0.0 112.427 -175.076 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -68.4 -31.06 70.15 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 172.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.495 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 97.7 mt -66.89 -51.34 56.58 Favored 'General case' 0 C--N 1.352 0.709 0 CA-C-O 119.113 -0.47 . . . . 0.0 110.232 170.326 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -49.83 -51.67 38.18 Favored 'General case' 0 N--CA 1.483 1.209 0 O-C-N 124.303 1.002 . . . . 0.0 111.923 -177.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.413 ' HB2' ' O ' ' A' ' 34' ' ' PHE . 7.3 ptp85 -64.63 -38.66 91.77 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 123.306 0.379 . . . . 0.0 111.248 177.131 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -65.16 -33.53 76.24 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.581 0.752 . . . . 0.0 112.322 -177.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 4.1 pp -103.39 -17.03 15.43 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -175.554 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 71.4 m-70 -87.62 18.27 4.09 Favored 'General case' 0 N--CA 1.486 1.33 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 167.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -47.87 -32.49 6.27 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 126.341 1.856 . . . . 0.0 114.23 176.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.46 ' H ' HD11 ' A' ' 30' ' ' ILE . 0.1 OUTLIER -67.68 -26.97 36.53 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.227 0 C-N-CA 124.334 1.054 . . . . 0.0 112.65 -177.381 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -116.3 -17.4 10.76 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.821 0.848 . . . . 0.0 111.117 -179.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -122.87 124.01 42.28 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.169 0.987 . . . . 0.0 109.628 -173.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -89.67 12.6 16.41 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.582 0.753 . . . . 0.0 110.934 177.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.413 ' O ' ' HB2' ' A' ' 25' ' ' ARG . 86.8 m-85 -97.11 99.69 11.18 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 124.606 1.163 . . . . 0.0 109.768 -172.567 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -105.35 -44.3 4.76 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.531 0.733 . . . . 0.0 109.766 175.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 65.86 167.77 0.11 Allowed Pre-proline 0 CA--C 1.572 1.79 0 C-N-CA 124.26 1.024 . . . . 0.0 111.816 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.485 ' HD2' ' HB2' ' A' ' 41' ' ' ASP . 53.3 Cg_exo -57.72 -165.02 0.02 OUTLIER 'Trans proline' 0 C--N 1.388 2.645 0 C-N-CA 123.286 2.657 . . . . 0.0 115.107 172.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 39.1 mmt180 -65.18 -37.73 88.27 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.283 0.633 . . . . 0.0 110.611 174.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -79.15 150.08 73.92 Favored Pre-proline 0 CA--C 1.548 0.883 0 CA-C-N 115.078 -0.965 . . . . 0.0 108.735 168.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -62.75 -22.85 74.28 Favored 'Trans proline' 0 C--N 1.379 2.139 0 C-N-CA 122.399 2.066 . . . . 0.0 112.987 -176.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.485 ' HB2' ' HD2' ' A' ' 37' ' ' PRO . 24.6 t70 77.1 -51.15 0.56 Allowed 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 125.923 1.689 . . . . 0.0 112.736 174.335 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -52.29 118.11 3.3 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.186 0.995 . . . . 0.0 110.765 177.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -59.06 -58.22 9.61 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.524 0.73 . . . . 0.0 110.355 -174.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -84.3 144.19 29.04 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 165.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.428 ' HD3' ' HD2' ' A' ' 21' ' ' ARG . 59.3 ttm-85 -66.96 86.85 0.14 Allowed 'General case' 0 CA--C 1.553 1.083 0 O-C-N 124.084 0.865 . . . . 0.0 111.05 -174.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.05 122.79 24.08 Favored 'General case' 0 C--O 1.244 0.765 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.878 -175.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 40.2 m -143.22 -71.82 0.3 Allowed 'General case' 0 C--O 1.244 0.773 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 176.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 53.36 -168.59 0.05 Allowed 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 124.211 1.004 . . . . 0.0 111.172 -170.408 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 11.8 mtm-85 61.07 -170.01 0.16 Allowed 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.295 0.638 . . . . 0.0 111.974 173.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.4 p -170.9 -52.24 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.844 0.857 . . . . 0.0 109.171 174.002 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 66.43 108.5 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.538 1.535 . . . . 0.0 111.157 178.063 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -69.6 -34.83 74.67 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.45 0.7 . . . . 0.0 110.84 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -63.05 123.98 19.96 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 123.565 0.541 . . . . 0.0 110.482 -179.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 98.9 t -66.16 -47.13 85.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 O-C-N 123.864 0.728 . . . . 0.0 109.762 -178.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 35.8 tp 67.1 117.62 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 125.105 1.362 . . . . 0.0 111.773 175.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -72.19 -15.94 61.96 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.593 0.757 . . . . 0.0 112.05 -175.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -71.25 -85.41 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 122.528 0.331 . . . . 0.0 110.2 178.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.43 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 59.3 mt 31.06 -89.21 0.0 OUTLIER 'General case' 0 CA--C 1.558 1.267 0 C-N-CA 126.388 1.875 . . . . 0.0 114.423 -172.505 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 159.41 101.69 0.17 Allowed Glycine 0 C--N 1.342 0.91 0 N-CA-C 110.149 -1.18 . . . . 0.0 110.149 -172.029 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -48.16 -53.33 17.15 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 124.552 1.141 . . . . 0.0 113.363 -168.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.466 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 95.1 t -57.59 -44.1 84.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 O-C-N 124.061 0.851 . . . . 0.0 110.425 -179.353 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -67.97 -33.36 79.14 Favored Glycine 0 C--N 1.347 1.179 0 O-C-N 123.98 0.8 . . . . 0.0 113.394 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -72.08 -43.67 64.47 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.521 0.728 . . . . 0.0 110.62 -179.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -70.22 -35.73 74.06 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.867 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' A' ' 61' ' ' VAL . 2.1 tp10 -66.39 -47.56 72.92 Favored 'General case' 0 C--N 1.349 0.554 0 CA-C-N 114.866 -1.061 . . . . 0.0 109.145 179.362 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 10.5 mt -51.33 -46.82 62.77 Favored 'General case' 0 N--CA 1.482 1.134 0 O-C-N 124.544 1.153 . . . . 0.0 110.999 173.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -64.01 -36.77 85.08 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.644 -176.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -74.76 -33.71 62.36 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.843 0.857 . . . . 0.0 111.469 177.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.571 HG22 ' HB3' ' A' ' 20' ' ' GLN . 69.9 mt -69.16 -55.85 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.782 0.833 . . . . 0.0 110.078 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -66.59 -21.91 66.13 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.567 1.147 . . . . 0.0 112.221 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.82 -49.81 71.4 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 121.275 0.559 . . . . 0.0 109.818 170.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.464 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -66.59 -41.51 88.37 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.244 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.415 HD22 HD12 ' A' ' 76' ' ' ILE . 79.6 mt -63.36 -41.26 98.82 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 124.386 1.074 . . . . 0.0 111.707 178.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.18 -40.17 84.81 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.762 0.825 . . . . 0.0 110.347 174.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 79.5 mtt85 -76.07 -23.11 55.01 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 115.087 -0.96 . . . . 0.0 112.731 -179.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.464 HG13 ' O ' ' A' ' 72' ' ' ALA . 85.3 mt -71.68 -44.34 69.45 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 173.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.42 -33.13 75.02 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.753 176.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 26.0 t -83.17 -19.35 36.75 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.67 0.788 . . . . 0.0 111.279 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 84.83 10.26 79.34 Favored Glycine 0 C--N 1.349 1.281 0 C-N-CA 122.924 0.297 . . . . 0.0 113.747 179.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.7 t -113.84 30.81 6.98 Favored 'General case' 0 CA--C 1.558 1.269 0 C-N-CA 123.92 0.888 . . . . 0.0 110.441 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -67.37 147.29 53.12 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 122.014 -0.429 . . . . 0.0 110.41 171.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.476 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 74.61 44.61 25.77 Favored Glycine 0 C--N 1.345 1.068 0 O-C-N 123.551 0.532 . . . . 0.0 111.823 -177.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 85.5 m -123.13 123.01 39.86 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.7 0.8 . . . . 0.0 110.366 179.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 22.4 t -70.34 89.51 0.67 Allowed 'General case' 0 C--N 1.353 0.735 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 170.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 15.2 m -63.56 -30.27 49.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.832 0.853 . . . . 0.0 112.3 -169.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 57.1 tttm -69.23 -20.2 63.95 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.203 1.001 . . . . 0.0 111.128 179.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 7.0 m -119.49 -16.47 8.9 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.089 0.955 . . . . 0.0 111.386 -173.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 65.54 21.6 68.97 Favored Glycine 0 CA--C 1.539 1.562 0 C-N-CA 122.937 0.303 . . . . 0.0 112.956 -168.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -104.35 -170.2 1.73 Allowed 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.582 1.153 . . . . 0.0 110.987 -174.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.476 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 13.2 tpp180 -91.7 154.88 18.69 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.347 1.059 . . . . 0.0 110.494 178.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 31.8 mm -98.05 149.34 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 168.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.7 m -73.97 145.43 44.65 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.833 0.853 . . . . 0.0 109.526 175.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -62.63 -30.84 71.66 Favored 'General case' 0 N--CA 1.482 1.125 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 174.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.524 ' HA ' ' HE2' ' A' ' 97' ' ' LYS . 17.7 m-20 -62.36 -41.75 98.85 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.297 1.039 . . . . 0.0 111.295 175.536 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.409 ' HG3' HG23 ' A' ' 102' ' ' THR . 21.9 tpt180 -68.71 -40.55 79.91 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.1 176.766 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 94.4 mt -71.44 -32.24 68.11 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.152 0.581 . . . . 0.0 112.41 -177.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.665 ' HZ2' ' HB3' ' A' ' 97' ' ' LYS . 0.2 OUTLIER -78.13 -32.2 50.29 Favored 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -179.502 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.37 -41.33 56.63 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.003 0.921 . . . . 0.0 110.737 176.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.4 p -153.45 98.48 2.7 Favored Pre-proline 0 CA--C 1.556 1.175 0 C-N-CA 124.906 1.282 . . . . 0.0 108.803 -176.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_exo -68.73 -24.93 34.26 Favored 'Trans proline' 0 C--N 1.371 1.756 0 C-N-CA 122.584 2.189 . . . . 0.0 112.28 173.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 9.1 p90 -89.53 58.63 4.43 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.652 1.181 . . . . 0.0 109.988 -178.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.409 HG23 ' HG3' ' A' ' 95' ' ' ARG . 10.9 t -123.83 104.15 33.44 Favored Pre-proline 0 CA--C 1.559 1.294 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.684 -175.143 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -67.35 -36.63 20.09 Favored 'Trans proline' 0 C--N 1.378 2.126 0 C-N-CA 122.474 2.116 . . . . 0.0 111.839 174.191 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -99.69 174.73 6.09 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -178.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.585 ' SG ' ' HB2' ' A' ' 108' ' ' CYS . 24.9 p -98.38 179.09 4.83 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.343 0.657 . . . . 0.0 109.301 176.243 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -54.52 -56.88 14.34 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.739 0.816 . . . . 0.0 111.768 -179.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -69.32 -39.67 78.07 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.933 -176.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.585 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 80.6 m -78.66 -21.8 47.76 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -176.075 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -76.21 -33.12 59.26 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 171.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.87 -23.12 59.55 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.648 172.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -102.42 18.69 20.47 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.28 1.032 . . . . 0.0 112.048 -176.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 82.5 mt . . . . . 0 N--CA 1.482 1.141 0 C-N-CA 122.907 0.483 . . . . 0.0 110.478 175.255 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.655 ' H2 ' HD13 ' A' ' 1' ' ' LEU . 5.5 mp . . . . . 0 N--CA 1.481 1.109 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -155.09 116.73 4.07 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.485 0.714 . . . . 0.0 110.197 175.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 138.77 -126.4 3.4 Favored Glycine 0 C--N 1.346 1.09 0 N-CA-C 110.986 -0.846 . . . . 0.0 110.986 178.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 75.37 -81.66 0.94 Allowed Glycine 0 C--N 1.348 1.238 0 N-CA-C 111.693 -0.563 . . . . 0.0 111.693 178.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -96.32 -12.55 24.28 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.977 0.911 . . . . 0.0 110.802 176.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 66.8 m -104.19 169.02 8.73 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.498 0.719 . . . . 0.0 109.412 170.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 61.4 ttp -63.03 120.93 12.36 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 178.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -75.66 72.07 2.59 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.056 0.942 . . . . 0.0 111.845 -174.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 21.9 t -70.7 -29.1 36.58 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 CA-C-N 115.344 -0.844 . . . . 0.0 109.791 176.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -68.77 -38.07 79.8 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.668 0.787 . . . . 0.0 111.183 178.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 27.8 m -63.45 -37.99 89.43 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.815 174.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -70.8 -34.22 71.52 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.861 175.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.474 ' HG2' HG22 ' A' ' 76' ' ' ILE . 4.7 mm-40 -55.42 -59.23 5.1 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 124.107 0.963 . . . . 0.0 109.963 178.749 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.2 ptmt -66.82 -45.64 77.67 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.858 -174.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.496 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 12.3 tt -64.3 -36.04 75.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 CA-C-N 117.861 0.301 . . . . 0.0 110.624 -174.354 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.57 ' HB3' HG21 ' A' ' 69' ' ' ILE . 63.1 mt -66.67 -38.08 86.08 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.227 0.611 . . . . 0.0 110.82 176.597 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.432 ' HA ' ' HG2' ' A' ' 20' ' ' GLN . 96.2 mtt-85 -72.18 -26.08 61.93 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 123.513 0.508 . . . . 0.0 111.57 178.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 53.5 m-20 -74.2 -40.06 62.73 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 122.872 0.469 . . . . 0.0 110.305 173.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.496 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -67.22 -40.13 86.35 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.416 177.183 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.579 ' HB3' HG23 ' A' ' 69' ' ' ILE . 1.3 pt20 -71.37 -31.07 66.89 Favored 'General case' 0 C--O 1.204 -1.303 0 CA-C-O 118.906 -0.569 . . . . 0.0 109.691 178.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -56.2 -54.58 43.54 Favored 'General case' 0 N--CA 1.496 1.862 0 CA-C-N 118.618 0.645 . . . . 0.0 110.548 174.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -67.9 -35.22 78.11 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.857 -176.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.53 ' HA ' ' HG2' ' A' ' 26' ' ' ARG . 97.8 mt -69.11 -50.62 46.44 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 122.792 0.437 . . . . 0.0 111.396 176.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -51.24 -46.0 62.18 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 124.513 1.125 . . . . 0.0 111.026 -178.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.1 ptm180 -75.17 -32.61 61.32 Favored 'General case' 0 CA--C 1.549 0.923 0 O-C-N 123.428 0.455 . . . . 0.0 111.779 -179.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.53 ' HG2' ' HA ' ' A' ' 23' ' ' LEU . 6.3 ptm180 -74.01 -27.27 60.88 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-N 118.075 0.398 . . . . 0.0 111.417 -177.614 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.0 pp -89.56 -31.99 17.35 Favored 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 110.04 -0.355 . . . . 0.0 110.04 176.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 55.4 m-70 -86.02 29.78 0.71 Allowed 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.146 0.578 . . . . 0.0 110.276 169.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 18.3 pttp -50.61 -37.12 38.47 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 125.378 1.471 . . . . 0.0 112.619 176.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.437 HG12 ' HG2' ' A' ' 31' ' ' GLU . 0.2 OUTLIER -61.55 -29.83 46.91 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.081 0 C-N-CA 124.142 0.977 . . . . 0.0 111.86 178.022 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.437 ' HG2' HG12 ' A' ' 30' ' ' ILE . 30.3 mm-40 -96.97 -29.45 13.66 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.445 1.098 . . . . 0.0 110.877 177.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -91.83 66.46 5.14 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 122.211 1.005 . . . . 0.0 110.803 -171.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -79.78 -16.37 55.67 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-N 114.127 -1.397 . . . . 0.0 109.218 170.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -60.14 114.77 3.04 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.869 1.268 . . . . 0.0 110.735 178.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 16.8 tp10 -83.93 -19.83 34.01 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.435 0.694 . . . . 0.0 111.269 -177.391 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 4.1 pt-20 66.76 155.06 0.13 Allowed Pre-proline 0 N--CA 1.493 1.723 0 C-N-CA 125.97 1.708 . . . . 0.0 111.933 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -71.45 -86.85 0.0 OUTLIER 'Trans proline' 0 C--N 1.373 1.844 0 C-N-CA 121.601 1.534 . . . . 0.0 109.543 163.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 64.1 mtm-85 -141.09 17.01 2.27 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 124.556 1.142 . . . . 0.0 108.912 171.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -164.07 108.81 0.91 Allowed Pre-proline 0 CA--C 1.552 1.035 0 C-N-CA 124.311 1.045 . . . . 0.0 109.471 -172.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -96.41 6.17 1.75 Allowed 'Trans proline' 0 C--N 1.375 1.946 0 C-N-CA 123.02 2.48 . . . . 0.0 111.893 170.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -166.36 115.18 0.92 Allowed 'General case' 0 C--N 1.353 0.731 0 C-N-CA 124.374 1.07 . . . . 0.0 108.935 -177.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -100.73 38.15 1.58 Allowed 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.025 0.93 . . . . 0.0 109.612 178.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 60.78 61.33 1.7 Allowed 'General case' 0 C--O 1.242 0.695 0 C-N-CA 124.141 0.977 . . . . 0.0 108.63 -170.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.12 -26.94 66.05 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 114.409 -1.268 . . . . 0.0 110.379 175.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 65.14 50.75 1.77 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.683 1.193 . . . . 0.0 108.758 178.751 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -79.96 87.72 5.37 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-N 114.399 -1.273 . . . . 0.0 108.445 171.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 16.2 p -77.4 75.7 3.95 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-O 121.833 0.825 . . . . 0.0 110.244 -178.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -157.8 112.12 2.6 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.147 -1.388 . . . . 0.0 108.013 -179.316 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.476 ' HD2' HD22 ' A' ' 51' ' ' ASN . 14.1 ptt180 -86.13 169.56 13.0 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.679 0.792 . . . . 0.0 110.077 179.247 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 62.0 p -150.3 50.09 0.9 Allowed 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.036 0.534 . . . . 0.0 110.339 179.123 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.476 HD22 ' HD2' ' A' ' 49' ' ' ARG . 12.1 p30 -106.68 -171.17 1.84 Allowed 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 123.284 0.634 . . . . 0.0 110.013 175.526 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 35.0 t70 64.06 32.24 12.97 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 124.458 1.103 . . . . 0.0 110.194 178.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -90.54 142.78 27.39 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.025 -175.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 26.4 t -85.7 -8.33 11.11 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.263 0 C-N-CA 123.684 0.794 . . . . 0.0 110.789 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 34.8 tp -58.06 120.71 9.05 Favored 'General case' 0 C--N 1.36 1.037 0 C-N-CA 123.252 0.621 . . . . 0.0 111.29 -177.042 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -77.35 -15.56 59.33 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.73 0.812 . . . . 0.0 111.473 -177.326 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -79.91 5.95 12.48 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.354 0.662 . . . . 0.0 112.61 177.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 35.9 mt -86.16 142.67 28.47 Favored 'General case' 0 C--O 1.241 0.652 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 169.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -65.14 142.48 44.77 Favored Glycine 0 C--N 1.347 1.185 0 CA-C-O 119.524 -0.598 . . . . 0.0 112.309 178.267 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -58.34 -50.78 72.4 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.311 1.044 . . . . 0.0 111.286 -179.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 11.2 p -61.89 -33.66 59.06 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.261 177.042 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -67.23 -51.84 35.64 Favored Glycine 0 C--N 1.347 1.16 0 O-C-N 123.905 0.753 . . . . 0.0 112.443 -178.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -62.33 -43.87 97.82 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.06 0.944 . . . . 0.0 111.162 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -65.27 -48.04 74.6 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.973 -177.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -77.35 -27.38 52.69 Favored 'General case' 0 C--O 1.216 -0.669 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.83 -175.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.3 mp -59.72 -47.19 86.62 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-O 121.544 0.688 . . . . 0.0 109.286 169.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 40.0 ttt180 -60.57 -37.56 81.7 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 114.33 -1.304 . . . . 0.0 110.318 -178.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.33 -39.72 59.14 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.191 0.997 . . . . 0.0 111.741 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.579 HG23 ' HB3' ' A' ' 20' ' ' GLN . 67.8 mt -74.68 -57.87 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 123.713 0.805 . . . . 0.0 110.274 -177.288 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -56.2 -33.54 65.42 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.218 1.007 . . . . 0.0 111.79 177.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.44 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -63.53 -51.33 65.92 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 110.269 -0.271 . . . . 0.0 110.269 171.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.477 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -58.57 -44.78 89.87 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.942 0.897 . . . . 0.0 111.588 -177.788 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.415 HD22 ' HB2' ' A' ' 16' ' ' LEU . 95.8 mt -64.68 -38.43 90.96 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 124.745 1.218 . . . . 0.0 111.463 179.13 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.75 -33.38 74.74 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.728 176.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.44 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 79.8 mtt-85 -74.84 -25.49 59.03 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.511 0.724 . . . . 0.0 111.051 177.181 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.477 HG13 ' O ' ' A' ' 72' ' ' ALA . 82.7 mt -70.91 -46.43 68.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 172.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.36 -25.79 68.19 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.861 0.864 . . . . 0.0 111.347 176.359 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.9 t -83.9 -29.57 27.07 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.941 0.896 . . . . 0.0 111.133 174.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 84.94 14.8 68.82 Favored Glycine 0 C--N 1.349 1.297 0 C-N-CA 123.034 0.35 . . . . 0.0 113.421 -176.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 15.3 t -106.13 7.57 31.74 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 123.809 0.844 . . . . 0.0 110.819 178.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -67.55 145.47 54.87 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 171.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.402 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 83.68 12.91 76.8 Favored Glycine 0 C--N 1.344 0.972 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.864 -171.19 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 43.4 m -130.39 119.18 22.34 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.217 1.007 . . . . 0.0 109.792 175.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 41.9 t -64.28 100.56 0.35 Allowed 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.9 0.88 . . . . 0.0 109.314 171.361 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.439 HG12 ' NH1' ' A' ' 75' ' ' ARG . 24.9 m -67.4 -23.61 30.34 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.918 0 C-N-CA 123.841 0.856 . . . . 0.0 111.782 -179.616 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 42.4 tttm -70.48 -17.56 62.97 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.598 0.759 . . . . 0.0 110.86 174.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 54.3 m -112.14 -29.39 7.6 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 124.295 1.038 . . . . 0.0 111.811 177.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 69.4 22.24 76.31 Favored Glycine 0 CA--C 1.539 1.58 0 CA-C-N 116.176 -0.465 . . . . 0.0 112.406 -162.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -126.09 174.38 8.52 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 124.674 1.19 . . . . 0.0 109.209 -174.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.402 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 13.3 tpp180 -67.04 158.23 31.53 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 124.708 1.203 . . . . 0.0 112.629 -173.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 13.1 mm -100.19 146.37 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 N-CA-C 107.786 -1.191 . . . . 0.0 107.786 164.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.7 m -72.36 140.97 48.75 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 173.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -63.72 -29.25 70.49 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 175.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -55.66 -49.68 72.25 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.658 1.183 . . . . 0.0 110.117 173.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.446 ' HG3' HG23 ' A' ' 102' ' ' THR . 26.2 tpt180 -62.19 -46.41 89.04 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 113.907 -1.497 . . . . 0.0 110.804 178.407 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 97.1 mt -66.22 -39.74 89.81 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.538 0.735 . . . . 0.0 112.087 -175.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.483 ' HZ1' ' HB3' ' A' ' 97' ' ' LYS . 0.6 OUTLIER -74.87 -32.03 61.76 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 122.353 0.261 . . . . 0.0 110.435 -176.221 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -79.3 -43.16 24.19 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.645 0.778 . . . . 0.0 111.192 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.1 p -148.2 95.32 4.12 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 124.724 1.21 . . . . 0.0 108.473 -177.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -79.64 -6.5 14.44 Favored 'Trans proline' 0 C--N 1.371 1.714 0 C-N-CA 122.382 2.055 . . . . 0.0 113.579 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . 0.401 ' HB3' HD21 ' A' ' 16' ' ' LEU . 20.0 p90 -95.54 47.83 1.13 Allowed 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 121.732 0.777 . . . . 0.0 110.282 177.491 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.446 HG23 ' HG3' ' A' ' 95' ' ' ARG . 13.3 t -125.75 111.11 25.13 Favored Pre-proline 0 CA--C 1.559 1.302 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.241 178.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo -74.91 -13.48 21.63 Favored 'Trans proline' 0 C--N 1.369 1.651 0 C-N-CA 122.552 2.168 . . . . 0.0 111.834 169.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -104.4 156.76 17.66 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.425 1.09 . . . . 0.0 110.331 -176.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.401 ' SG ' ' HB2' ' A' ' 107' ' ' GLU . 30.6 p -83.8 171.1 13.45 Favored 'General case' 0 N--CA 1.481 1.113 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 172.671 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -59.8 -35.55 74.91 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.46 0.704 . . . . 0.0 111.057 -176.017 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.401 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 26.3 mt-10 -58.03 -54.41 47.29 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 114.902 -1.045 . . . . 0.0 110.738 173.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 79.9 m -64.91 -35.8 82.3 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 123.885 0.741 . . . . 0.0 111.485 -178.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -63.72 -45.28 90.65 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.889 0.875 . . . . 0.0 110.258 -179.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.67 -20.39 61.25 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.344 177.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -98.37 8.8 44.36 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.006 0.922 . . . . 0.0 112.227 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 89.3 mt . . . . . 0 N--CA 1.482 1.164 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 173.49 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.561 HD13 ' H3 ' ' A' ' 1' ' ' LEU . 8.0 mp . . . . . 0 N--CA 1.482 1.15 0 N-CA-C 110.232 -0.285 . . . . 0.0 110.232 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 68.43 17.52 9.13 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 125.145 1.378 . . . . 0.0 112.995 179.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 73.96 -84.61 0.69 Allowed Glycine 0 C--N 1.349 1.268 0 CA-C-O 119.821 -0.433 . . . . 0.0 113.358 178.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 74.67 -112.48 3.72 Favored Glycine 0 C--N 1.349 1.287 0 N-CA-C 112.241 -0.344 . . . . 0.0 112.241 -178.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -78.65 172.48 13.64 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 122.931 0.493 . . . . 0.0 109.858 171.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.9 t 64.84 29.89 12.39 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.249 1.02 . . . . 0.0 109.904 -175.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' MET . . . . . 0.41 ' HE3' HG23 ' A' ' 9' ' ' VAL . 55.2 ttp -64.34 119.14 9.76 Favored 'General case' 0 C--N 1.353 0.745 0 CA-C-N 115.074 -0.966 . . . . 0.0 108.725 172.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -76.1 72.28 2.9 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.219 0.608 . . . . 0.0 111.408 -173.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.41 HG23 ' HE3' ' A' ' 7' ' ' MET . 59.3 t -62.85 -36.04 73.76 Favored 'Isoleucine or valine' 0 C--N 1.351 0.671 0 C-N-CA 123.629 0.772 . . . . 0.0 110.342 -178.488 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -60.77 -38.81 86.53 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.962 0.905 . . . . 0.0 111.948 -179.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 28.5 m -64.92 -44.34 89.83 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.505 0.722 . . . . 0.0 110.004 175.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -69.47 -32.55 71.53 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.143 179.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -64.55 -54.92 24.54 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.438 1.095 . . . . 0.0 109.632 -176.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.583 ' HZ1' ' HB2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -66.01 -38.76 89.26 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.733 -176.679 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 12.6 tt -69.66 -31.36 48.43 Favored 'Isoleucine or valine' 0 C--N 1.362 1.113 0 N-CA-C 110.29 -0.263 . . . . 0.0 110.29 -179.176 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.547 ' HB3' HG23 ' A' ' 69' ' ' ILE . 55.3 mt -70.96 -38.51 72.79 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.273 0.629 . . . . 0.0 111.147 176.262 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.483 ' O ' ' HG3' ' A' ' 21' ' ' ARG . 1.3 mmp_? -59.63 -46.76 88.04 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 123.694 0.621 . . . . 0.0 110.049 176.009 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.504 ' HA ' ' HD2' ' A' ' 21' ' ' ARG . 3.8 m-20 -73.25 -32.9 64.98 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -69.04 -40.14 78.76 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 122.8 0.44 . . . . 0.0 110.639 179.411 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.579 ' HB3' HG22 ' A' ' 69' ' ' ILE . 3.5 pt20 -72.46 -31.38 65.38 Favored 'General case' 0 C--O 1.2 -1.54 0 CA-C-O 118.594 -0.717 . . . . 0.0 109.715 176.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.504 ' HD2' ' HA ' ' A' ' 18' ' ' ASP . 65.4 mtt-85 -58.49 -48.89 79.31 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-N 118.583 0.628 . . . . 0.0 111.276 178.551 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -70.58 -32.88 70.43 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.341 -178.031 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.487 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 96.6 mt -76.93 -34.02 57.68 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 122.724 0.41 . . . . 0.0 111.943 176.328 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -67.01 -51.13 58.74 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.954 0.901 . . . . 0.0 108.815 179.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.6 ptp180 -62.78 -32.13 73.24 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.538 0.735 . . . . 0.0 110.302 -179.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -60.79 -46.64 89.72 Favored 'General case' 0 C--N 1.363 1.174 0 C-N-CA 123.656 0.782 . . . . 0.0 111.782 176.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.571 ' HB2' ' HA ' ' A' ' 58' ' ' LEU . 2.7 pp -96.85 -0.37 47.95 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -177.741 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -116.31 25.93 10.29 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.895 0.878 . . . . 0.0 109.993 172.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.3 pttp -56.95 -30.8 64.38 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 124.699 1.2 . . . . 0.0 113.229 178.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.418 ' H ' HD11 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -65.32 -37.94 81.35 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 124.304 1.042 . . . . 0.0 112.546 179.351 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -102.77 -15.67 16.2 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.747 0.819 . . . . 0.0 111.308 -174.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -121.91 96.62 5.13 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.154 0.982 . . . . 0.0 109.4 -178.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -90.0 86.33 6.57 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -137.17 98.76 3.81 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -66.48 -45.46 79.58 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 121.886 0.851 . . . . 0.0 110.045 178.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -127.99 91.78 43.87 Favored Pre-proline 0 CA--C 1.54 0.59 0 N-CA-C 106.989 -1.485 . . . . 0.0 106.989 174.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -65.81 80.72 0.26 Allowed 'Trans proline' 0 C--N 1.375 1.939 0 C-N-CA 123.246 2.63 . . . . 0.0 111.776 178.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 90.8 mtt180 -107.13 118.75 37.54 Favored 'General case' 0 C--O 1.239 0.536 0 C-N-CA 123.897 0.879 . . . . 0.0 109.107 -178.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 26.3 p-10 -160.86 154.65 18.84 Favored Pre-proline 0 CA--C 1.545 0.782 0 C-N-CA 124.308 1.043 . . . . 0.0 109.371 179.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -58.81 -46.94 20.37 Favored 'Trans proline' 0 C--N 1.376 2.004 0 C-N-CA 122.614 2.209 . . . . 0.0 111.65 173.045 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.5 t70 63.27 87.69 0.1 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.084 1.354 . . . . 0.0 111.563 175.195 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -139.77 85.76 2.06 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.839 0.855 . . . . 0.0 108.777 176.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -172.72 -102.45 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.538 1.135 . . . . 0.0 108.081 173.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 36.1 t70 167.12 149.25 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 126.179 1.792 . . . . 0.0 107.897 -178.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 12.7 tpt180 -132.55 66.26 1.56 Allowed 'General case' 0 C--O 1.244 0.79 0 CA-C-O 121.912 0.863 . . . . 0.0 110.313 176.156 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.63 102.44 7.99 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 163.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 38.0 m -66.64 142.35 57.49 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.236 0.614 . . . . 0.0 110.907 -174.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 18.6 mp0 -74.01 89.96 1.96 Allowed 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.991 0.916 . . . . 0.0 109.487 -174.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.1 mpt_? 66.41 118.39 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 125.035 1.334 . . . . 0.0 110.848 -175.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.0 m -67.74 131.54 45.75 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.706 0.802 . . . . 0.0 109.877 177.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -61.38 130.14 44.66 Favored 'General case' 0 C--N 1.352 0.701 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 168.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -80.72 50.78 1.39 Allowed 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.275 1.03 . . . . 0.0 112.493 -170.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 58.87 38.45 24.53 Favored 'General case' 0 C--N 1.358 0.943 0 C-N-CA 125.138 1.375 . . . . 0.0 111.002 175.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 62.9 t -66.49 -45.53 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 CA-C-N 114.77 -1.104 . . . . 0.0 110.424 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 27.2 tp -86.71 138.15 31.87 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.375 -179.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -86.99 0.15 55.65 Favored 'General case' 0 CA--C 1.558 1.265 0 C-N-CA 123.798 0.839 . . . . 0.0 111.924 -174.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -65.26 -18.87 65.66 Favored 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 123.257 0.623 . . . . 0.0 112.359 175.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.571 ' HA ' ' HB2' ' A' ' 27' ' ' LEU . 6.4 mp -78.27 108.58 11.71 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.243 173.173 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -76.99 143.47 28.8 Favored Glycine 0 N--CA 1.471 0.988 0 CA-C-O 118.502 -1.165 . . . . 0.0 110.992 179.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -51.81 -52.56 48.23 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 124.348 1.059 . . . . 0.0 112.546 -171.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.443 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 7.5 p -53.6 -39.12 36.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 O-C-N 123.841 0.713 . . . . 0.0 111.761 177.124 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.404 ' O ' HD12 ' A' ' 66' ' ' LEU . . . -68.59 -43.28 77.41 Favored Glycine 0 C--N 1.345 1.069 0 O-C-N 123.616 0.573 . . . . 0.0 112.152 177.285 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -67.26 -41.57 85.32 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.637 0.775 . . . . 0.0 110.997 -175.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -74.74 -28.23 60.69 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 124.094 0.871 . . . . 0.0 111.239 179.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.443 ' HB2' ' O ' ' A' ' 61' ' ' VAL . 0.5 OUTLIER -71.73 -44.86 63.4 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 177.63 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.404 HD12 ' O ' ' A' ' 62' ' ' GLY . 5.8 mp -57.0 -47.83 79.9 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.759 1.224 . . . . 0.0 110.171 170.416 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -61.47 -37.21 82.78 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.132 0.973 . . . . 0.0 110.834 -176.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.67 -40.97 65.88 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.064 0.946 . . . . 0.0 111.021 177.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.579 HG22 ' HB3' ' A' ' 20' ' ' GLN . 83.3 mt -66.29 -53.33 37.65 Favored 'Isoleucine or valine' 0 C--N 1.356 0.857 0 C-N-CA 123.493 0.717 . . . . 0.0 110.804 -179.205 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -65.35 -27.28 68.47 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.943 0.897 . . . . 0.0 111.925 178.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.3 -37.02 77.59 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 122.686 0.394 . . . . 0.0 110.326 172.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.513 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -69.62 -41.71 75.32 Favored 'General case' 0 C--N 1.348 0.507 0 C-N-CA 123.368 0.667 . . . . 0.0 110.644 176.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.507 HD22 HD12 ' A' ' 76' ' ' ILE . 86.5 mt -68.02 -32.55 73.0 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.181 0.993 . . . . 0.0 110.923 179.137 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.5 -38.93 85.07 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.819 0.848 . . . . 0.0 110.383 173.047 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 87.1 mtm180 -67.69 -30.53 70.07 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.979 174.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.513 HG13 ' O ' ' A' ' 72' ' ' ALA . 74.2 mt -70.84 -40.85 77.1 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 175.571 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.5 -32.46 72.49 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.896 0.878 . . . . 0.0 111.526 177.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.48 ' HB3' HG22 ' A' ' 80' ' ' THR . 34.2 t -88.08 -22.54 24.11 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.465 0.706 . . . . 0.0 111.154 176.453 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 85.31 9.77 78.9 Favored Glycine 0 C--N 1.346 1.116 0 CA-C-N 116.594 -0.275 . . . . 0.0 113.058 -175.552 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.48 HG22 ' HB3' ' A' ' 78' ' ' SER . 15.0 t -102.97 26.4 8.21 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.221 1.008 . . . . 0.0 109.612 179.302 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 90.9 t80 -63.93 147.74 51.23 Favored 'General case' 0 C--N 1.351 0.642 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 171.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 69.56 46.39 55.33 Favored Glycine 0 C--N 1.341 0.854 0 N-CA-C 110.737 -0.945 . . . . 0.0 110.737 -172.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 98.7 m -129.63 116.95 19.61 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.703 0.801 . . . . 0.0 110.167 174.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 42.9 t -68.52 100.26 1.08 Allowed 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 166.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 33.7 m -62.19 -27.4 42.48 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 123.995 0.918 . . . . 0.0 112.456 -176.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.503 ' HD2' ' HB3' ' A' ' 108' ' ' CYS . 24.5 ttmm -67.21 -33.69 75.9 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.496 0.718 . . . . 0.0 110.24 174.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 54.7 m -86.89 -29.18 22.34 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.632 0.773 . . . . 0.0 111.149 174.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 66.99 22.09 72.05 Favored Glycine 0 C--N 1.342 0.894 0 CA-C-N 115.79 -0.641 . . . . 0.0 112.392 -165.2 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -138.1 173.44 11.62 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.764 0.826 . . . . 0.0 110.684 -173.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 -64.89 151.47 45.54 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.943 1.297 . . . . 0.0 114.335 -170.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 13.7 mm -90.94 150.78 3.64 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.952 0 C-N-CA 125.537 1.535 . . . . 0.0 109.131 173.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 31.6 m -75.97 151.95 37.13 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 175.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -59.16 -41.62 88.79 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.202 0.601 . . . . 0.0 111.142 -179.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -61.7 -39.46 91.55 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.042 0.937 . . . . 0.0 111.217 -178.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.499 ' HE ' HG21 ' A' ' 102' ' ' THR . 29.7 tpt180 -64.74 -42.98 94.79 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.741 176.293 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 92.1 mt -67.98 -41.6 82.1 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.362 0.665 . . . . 0.0 112.209 -176.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -71.8 -28.3 63.51 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 122.587 0.355 . . . . 0.0 110.55 -178.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.22 -38.3 27.21 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.54 0.736 . . . . 0.0 110.884 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.4 p -160.76 95.55 1.45 Allowed Pre-proline 0 CA--C 1.559 1.291 0 C-N-CA 124.738 1.215 . . . . 0.0 109.501 -176.108 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . 0.511 ' HG2' HD21 ' A' ' 16' ' ' LEU . 69.2 Cg_endo -77.56 -23.28 9.97 Favored 'Trans proline' 0 C--N 1.375 1.972 0 C-N-CA 122.618 2.212 . . . . 0.0 113.539 -178.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 32.1 p90 -80.93 -9.3 59.85 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 -174.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.499 HG21 ' HE ' ' A' ' 95' ' ' ARG . 12.4 t -64.87 125.99 90.14 Favored Pre-proline 0 CA--C 1.565 1.527 0 CA-C-N 117.731 0.242 . . . . 0.0 111.187 -176.199 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -75.83 -12.93 19.89 Favored 'Trans proline' 0 C--N 1.375 1.931 0 C-N-CA 122.62 2.213 . . . . 0.0 112.627 174.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -121.68 157.11 31.6 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.608 0.763 . . . . 0.0 110.161 -176.268 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.48 ' SG ' ' OE1' ' A' ' 107' ' ' GLU . 29.3 p -86.02 165.21 16.86 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 175.607 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -46.39 -44.16 16.89 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 124.886 1.274 . . . . 0.0 114.35 -160.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.48 ' OE1' ' SG ' ' A' ' 105' ' ' CYS . 0.0 OUTLIER -84.04 -26.86 28.76 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 122.215 -0.303 . . . . 0.0 110.787 -176.286 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.503 ' HB3' ' HD2' ' A' ' 86' ' ' LYS . 95.7 m -69.86 -26.45 64.21 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.961 0.904 . . . . 0.0 110.473 174.499 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -75.45 -36.23 60.74 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.851 0.86 . . . . 0.0 110.048 172.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -78.13 -8.86 58.8 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.942 173.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -86.11 -9.47 56.61 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.647 0.779 . . . . 0.0 111.117 174.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 55.1 mt . . . . . 0 CA--C 1.554 1.104 0 C-N-CA 123.127 0.571 . . . . 0.0 109.542 176.086 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.6 tt . . . . . 0 N--CA 1.482 1.126 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 66.7 165.52 0.21 Allowed 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 125.051 1.34 . . . . 0.0 112.397 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 178.3 56.39 0.07 OUTLIER Glycine 0 C--N 1.341 0.85 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.796 -178.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -80.66 72.85 2.62 Favored Glycine 0 C--N 1.342 0.893 0 CA-C-N 115.305 -0.447 . . . . 0.0 112.777 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -78.11 137.74 38.36 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.355 0.662 . . . . 0.0 109.948 176.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 19.8 m -61.77 -36.09 80.02 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.764 0.826 . . . . 0.0 112.334 -172.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 26.8 ptm -76.32 -22.14 55.33 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-O 119.108 -0.473 . . . . 0.0 111.213 179.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 11.5 m120 73.75 44.18 0.3 Allowed 'General case' 0 N--CA 1.494 1.754 0 C-N-CA 125.442 1.497 . . . . 0.0 112.47 176.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.5 t -50.98 -46.83 30.64 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 C-N-CA 123.571 0.748 . . . . 0.0 112.088 175.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -65.56 -36.01 82.53 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.515 0.726 . . . . 0.0 111.681 -176.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.0 m -67.11 -37.97 84.82 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.256 176.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -70.23 -35.5 73.88 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.272 176.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.1 tm-20 -60.71 -57.63 11.87 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.984 0.913 . . . . 0.0 109.381 -176.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.434 ' HG3' ' N ' ' A' ' 15' ' ' ILE . 12.8 ptmt -63.82 -42.11 97.73 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.592 -176.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.434 ' N ' ' HG3' ' A' ' 14' ' ' LYS . 15.2 tt -68.78 -29.48 43.72 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 -175.061 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.528 ' HB3' HG22 ' A' ' 69' ' ' ILE . 70.7 mt -74.01 -35.48 64.39 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.241 0.616 . . . . 0.0 110.779 174.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.436 ' NH2' HD12 ' A' ' 73' ' ' LEU . 1.7 mmp_? -59.98 -49.28 78.29 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 172.356 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 49.2 m-20 -64.12 -41.64 97.15 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 124.006 0.922 . . . . 0.0 110.943 -177.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -66.87 -46.02 76.29 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.68 -178.626 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.541 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.8 pt20 -67.45 -29.25 68.67 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-O 118.871 -0.585 . . . . 0.0 110.099 -179.394 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.3 mmt180 -70.22 -46.86 63.64 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.708 0.803 . . . . 0.0 111.867 -179.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -68.43 -32.7 72.92 Favored 'General case' 0 N--CA 1.48 1.067 0 O-C-N 123.238 0.336 . . . . 0.0 110.542 178.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.4 HD13 ' HB3' ' A' ' 65' ' ' GLU . 97.1 mt -74.54 -33.29 62.7 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.021 174.401 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -58.89 -59.66 5.09 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 38.3 ptt180 -59.01 -37.57 77.21 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 123.719 0.637 . . . . 0.0 111.28 -178.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 75.5 ttt180 -57.42 -56.11 26.15 Favored 'General case' 0 C--N 1.356 0.874 0 C-N-CA 124.119 0.968 . . . . 0.0 112.046 178.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.419 ' O ' ' HA ' ' A' ' 58' ' ' LEU . 4.5 pp -87.85 -22.55 24.39 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -172.536 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -90.39 23.46 2.94 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 175.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.4 ptpp? -44.17 -34.3 1.8 Allowed 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 126.582 1.953 . . . . 0.0 113.831 179.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.44 HG12 ' HG2' ' A' ' 31' ' ' GLU . 0.2 OUTLIER -60.76 -32.19 51.33 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.123 0 C-N-CA 124.22 1.008 . . . . 0.0 111.775 -179.811 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.44 ' HG2' HG12 ' A' ' 30' ' ' ILE . 19.2 mm-40 -97.75 -53.08 3.53 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.585 1.154 . . . . 0.0 109.553 175.453 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -78.17 95.48 4.95 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-N 114.173 -1.376 . . . . 0.0 110.561 -173.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -74.82 125.57 29.07 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 114.801 -1.091 . . . . 0.0 109.266 175.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 -82.7 54.8 2.78 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.893 0.877 . . . . 0.0 111.313 -177.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -76.71 -44.95 31.39 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.388 0.675 . . . . 0.0 109.333 173.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -106.74 129.59 24.18 Favored Pre-proline 0 CA--C 1.552 1.04 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.395 -178.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_exo -74.41 92.71 0.92 Allowed 'Trans proline' 0 C--N 1.377 2.059 0 C-N-CA 122.874 2.383 . . . . 0.0 109.517 167.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 16.2 mtp180 -70.82 143.95 50.95 Favored 'General case' 0 N--CA 1.478 0.962 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.586 -174.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -65.01 145.46 99.1 Favored Pre-proline 0 N--CA 1.478 0.949 0 C-N-CA 123.64 0.776 . . . . 0.0 110.744 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -76.95 69.17 7.08 Favored 'Trans proline' 0 C--N 1.384 2.412 0 C-N-CA 122.867 2.378 . . . . 0.0 110.518 176.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.7 t70 172.43 -43.97 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 126.059 1.744 . . . . 0.0 107.591 -171.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 25.5 t70 60.07 -126.89 1.1 Allowed 'General case' 0 CA--C 1.562 1.425 0 CA-C-N 113.888 -1.506 . . . . 0.0 109.438 -179.022 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -165.41 19.21 0.05 OUTLIER 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.939 0.895 . . . . 0.0 110.613 179.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -109.3 100.17 9.32 Favored 'General case' 0 C--O 1.24 0.577 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -74.14 -29.34 61.76 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.163 178.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.5 78.39 1.44 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.586 0.754 . . . . 0.0 110.48 -179.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.5 m -94.24 82.09 4.09 Favored 'General case' 0 C--O 1.241 0.643 0 C-N-CA 123.743 0.817 . . . . 0.0 109.256 -177.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -68.0 121.3 15.8 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.859 -178.531 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 29.1 ptt180 -84.41 92.42 8.05 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.057 0.943 . . . . 0.0 110.06 178.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 36.0 p -155.62 80.21 1.02 Allowed 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.352 0.596 . . . . 0.0 109.99 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 63.0 t30 -95.28 78.41 3.46 Favored 'General case' 0 C--O 1.244 0.766 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 178.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -89.53 79.6 6.86 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -68.75 102.78 1.6 Allowed 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 113.63 -1.623 . . . . 0.0 111.287 -176.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 47.7 t -124.14 -43.75 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 176.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 30.0 tp -83.55 125.5 31.84 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.181 175.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -93.5 12.82 23.77 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 123.545 0.738 . . . . 0.0 111.144 -175.361 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -83.32 13.68 4.14 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.323 0.649 . . . . 0.0 111.351 174.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.419 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 68.5 mt -79.62 -70.28 0.52 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 122.94 0.496 . . . . 0.0 110.413 178.01 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 127.0 114.51 1.88 Allowed Glycine 0 N--CA 1.472 1.035 0 N-CA-C 110.819 -0.913 . . . . 0.0 110.819 -176.392 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -49.93 -52.62 31.93 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.273 1.429 . . . . 0.0 113.37 -170.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 7.4 p -53.08 -42.56 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 123.234 0.614 . . . . 0.0 112.205 -178.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -74.74 -32.83 56.73 Favored Glycine 0 C--N 1.344 1.011 0 CA-C-N 115.538 -0.756 . . . . 0.0 112.113 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -68.34 -45.76 71.99 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.626 0.77 . . . . 0.0 111.43 -179.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -64.76 -36.75 85.32 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.542 0.737 . . . . 0.0 109.662 176.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.4 ' HB3' HD13 ' A' ' 23' ' ' LEU . 0.9 OUTLIER -64.31 -48.56 75.18 Favored 'General case' 0 C--N 1.354 0.789 0 O-C-N 124.122 0.889 . . . . 0.0 110.467 177.416 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.4 mp -57.38 -46.62 83.2 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.175 0.99 . . . . 0.0 110.635 177.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 77.2 ttt180 -62.24 -37.1 84.11 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.508 -178.1 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.432 ' HB1' ' O ' ' A' ' 101' ' ' TYR . . . -74.53 -39.33 62.43 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 123.995 0.918 . . . . 0.0 111.542 179.201 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.541 HG21 ' HB3' ' A' ' 20' ' ' GLN . 85.3 mt -73.06 -54.92 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 123.785 0.834 . . . . 0.0 110.39 -176.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -59.67 -30.18 68.58 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.05 0.94 . . . . 0.0 111.789 176.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.472 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -64.11 -52.68 57.99 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 123.429 0.456 . . . . 0.0 110.319 172.094 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.46 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -61.2 -40.41 93.84 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.929 0.892 . . . . 0.0 111.496 -178.138 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.5 HD22 HD13 ' A' ' 76' ' ' ILE . 66.1 mt -67.84 -37.1 81.46 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.711 1.205 . . . . 0.0 111.505 178.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.61 -33.04 75.01 Favored 'General case' 0 N--CA 1.478 0.951 0 O-C-N 123.615 0.572 . . . . 0.0 110.296 173.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.472 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 79.7 mtt-85 -79.99 -25.91 40.12 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.274 0.629 . . . . 0.0 111.466 178.288 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.5 HD13 HD22 ' A' ' 73' ' ' LEU . 98.1 mt -71.33 -49.9 44.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 175.708 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.19 -28.09 68.49 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.606 0.762 . . . . 0.0 111.106 178.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 30.5 t -75.56 -34.22 60.7 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.43 0.692 . . . . 0.0 110.627 172.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 90.78 7.94 65.88 Favored Glycine 0 CA--C 1.53 0.989 0 CA-C-N 115.759 -0.655 . . . . 0.0 113.158 -176.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 14.0 t -97.44 10.35 39.95 Favored 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 123.669 0.788 . . . . 0.0 110.481 178.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -64.93 136.55 56.95 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.082 0.553 . . . . 0.0 109.914 171.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.15 13.14 64.51 Favored Glycine 0 CA--C 1.527 0.803 0 O-C-N 123.619 0.575 . . . . 0.0 111.89 -169.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 89.4 m -125.68 119.67 28.63 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 123.741 0.816 . . . . 0.0 109.753 175.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.418 ' HB2' HD12 ' A' ' 91' ' ' ILE . 49.6 t -77.06 91.89 3.7 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 124.072 0.949 . . . . 0.0 109.743 170.635 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 25.3 m -64.35 -20.02 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 124.016 0.927 . . . . 0.0 112.152 -178.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 49.8 tttm -66.41 -22.8 66.24 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.928 0.891 . . . . 0.0 111.874 -179.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.437 ' SG ' ' HB2' ' A' ' 89' ' ' LYS . 31.7 p -137.85 10.07 2.85 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 122.635 0.374 . . . . 0.0 111.488 177.014 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 63.85 20.21 64.07 Favored Glycine 0 C--N 1.358 1.76 0 N-CA-C 114.185 0.434 . . . . 0.0 114.185 179.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.437 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 31.6 mmmt -106.92 -173.77 2.37 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.094 0.958 . . . . 0.0 110.62 -176.487 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 13.1 mmm180 -83.54 163.84 20.18 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 124.454 1.102 . . . . 0.0 112.139 176.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.418 HD12 ' HB2' ' A' ' 84' ' ' CYS . 5.7 mm -101.21 143.43 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 N-CA-C 106.416 -1.698 . . . . 0.0 106.416 159.361 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.6 m -70.9 140.82 51.13 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 173.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -61.06 -35.86 78.08 Favored 'General case' 0 N--CA 1.483 1.185 0 CA-C-N 117.95 0.341 . . . . 0.0 110.124 174.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -58.29 -40.92 83.23 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.187 0.995 . . . . 0.0 110.34 175.337 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.524 ' HD2' ' HB2' ' A' ' 106' ' ' GLN . 0.2 OUTLIER -68.71 -40.19 80.08 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.699 176.947 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 94.6 mt -69.01 -34.81 75.87 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.844 0.858 . . . . 0.0 112.307 -176.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 15.5 ptpt -80.73 -27.08 36.99 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 122.627 0.371 . . . . 0.0 110.215 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -79.31 -29.36 42.34 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.643 0.777 . . . . 0.0 110.999 175.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.3 p -165.84 99.9 0.74 Allowed Pre-proline 0 CA--C 1.557 1.244 0 C-N-CA 124.828 1.251 . . . . 0.0 108.909 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . 0.436 ' HG2' HD21 ' A' ' 16' ' ' LEU . 79.2 Cg_endo -78.21 -12.93 15.65 Favored 'Trans proline' 0 C--N 1.373 1.845 0 C-N-CA 122.65 2.233 . . . . 0.0 113.681 179.113 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . 0.432 ' O ' ' HB1' ' A' ' 68' ' ' ALA . 24.0 p90 -94.66 22.02 6.73 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 122.601 0.361 . . . . 0.0 111.932 -179.211 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 14.1 t -97.51 112.48 61.35 Favored Pre-proline 0 CA--C 1.56 1.358 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 172.526 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -78.39 -4.44 14.22 Favored 'Trans proline' 0 C--N 1.376 1.977 0 C-N-CA 122.635 2.224 . . . . 0.0 112.009 171.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -114.75 146.15 41.29 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.957 0.903 . . . . 0.0 109.975 -176.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 26.0 p -75.67 160.72 29.77 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 175.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.524 ' HB2' ' HD2' ' A' ' 95' ' ' ARG . 52.0 tp60 -56.61 -29.95 62.73 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 118.387 0.539 . . . . 0.0 111.779 -175.312 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -61.57 -49.75 75.41 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 124.826 1.25 . . . . 0.0 109.844 177.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 98.3 m -70.3 -36.29 74.25 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.346 0.658 . . . . 0.0 111.662 177.047 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -61.38 -33.97 74.55 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.782 0.833 . . . . 0.0 110.968 179.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -82.6 -28.91 30.52 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.819 0.847 . . . . 0.0 111.152 175.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -105.47 24.46 12.12 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 124.065 0.946 . . . . 0.0 112.61 -174.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 86.3 mt . . . . . 0 N--CA 1.487 1.412 0 C-N-CA 123.464 0.706 . . . . 0.0 111.193 177.976 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.588 ' H3 ' HD11 ' A' ' 1' ' ' LEU . 7.8 mp . . . . . 0 N--CA 1.476 0.853 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -162.05 16.15 0.09 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.541 1.136 . . . . 0.0 109.808 174.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -69.79 138.21 29.69 Favored Glycine 0 C--N 1.356 1.661 0 CA-C-N 115.952 -0.567 . . . . 0.0 113.32 -174.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 86.37 140.66 5.97 Favored Glycine 0 C--N 1.348 1.235 0 N-CA-C 111.977 -0.449 . . . . 0.0 111.977 -177.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -102.29 17.28 23.84 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.966 0.906 . . . . 0.0 111.143 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 32.8 m -61.91 -44.52 96.62 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.78 0.832 . . . . 0.0 111.842 -175.043 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' MET . . . . . 0.43 ' HE1' ' HD2' ' A' ' 90' ' ' ARG . 45.5 ttm -71.81 -38.06 70.27 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.047 177.387 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 52.5 t30 57.27 100.1 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 125.6 1.56 . . . . 0.0 112.026 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.8 t -71.57 -26.43 26.24 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.034 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.199 -179.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -58.53 -42.21 87.26 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 123.207 0.603 . . . . 0.0 112.544 -174.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 33.2 m -59.73 -41.86 91.83 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 121.352 0.596 . . . . 0.0 110.833 178.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -71.34 -38.39 71.66 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-N 114.942 -1.026 . . . . 0.0 110.487 179.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.461 ' O ' ' HG3' ' A' ' 17' ' ' ARG . 3.0 tm-20 -57.9 -54.95 41.09 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.507 1.123 . . . . 0.0 110.127 -177.546 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.544 ' HB2' ' HZ2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -66.56 -41.59 88.4 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.171 -176.771 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 14.9 tt -68.22 -29.94 46.14 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 N-CA-C 110.329 -0.249 . . . . 0.0 110.329 -177.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.535 ' HB3' HG21 ' A' ' 69' ' ' ILE . 77.5 mt -73.35 -33.19 64.96 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.673 0.789 . . . . 0.0 111.168 176.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.461 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 25.7 mtm180 -64.51 -37.51 87.78 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 175.274 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -82.52 -24.68 33.98 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.002 0.521 . . . . 0.0 110.522 -178.536 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.402 ' HD2' ' HA ' ' A' ' 19' ' ' ARG . 18.4 tpt180 -73.45 -43.45 60.29 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.505 179.347 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.537 ' HB3' HG23 ' A' ' 69' ' ' ILE . 2.7 pt20 -73.45 -29.46 62.56 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 119.005 -0.521 . . . . 0.0 110.018 176.467 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 91.8 mtt180 -55.29 -58.29 8.32 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 172.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -63.78 -38.24 90.37 Favored 'General case' 0 C--N 1.352 0.686 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.098 -175.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.689 HD22 HH11 ' A' ' 26' ' ' ARG . 89.4 mt -65.34 -52.24 55.12 Favored 'General case' 0 C--O 1.216 -0.688 0 O-C-N 123.877 0.735 . . . . 0.0 110.956 177.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -48.0 -53.49 16.03 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 124.303 1.041 . . . . 0.0 111.25 -178.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -74.88 -26.19 59.49 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -178.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.689 HH11 HD22 ' A' ' 23' ' ' LEU . 39.5 ttm180 -66.58 -48.94 67.97 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.832 0.853 . . . . 0.0 111.124 175.607 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.506 HD22 HD23 ' A' ' 66' ' ' LEU . 4.1 pp -80.38 -24.69 39.59 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.31 0.644 . . . . 0.0 110.679 -178.192 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 52.6 m170 -80.92 21.04 0.72 Allowed 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.171 0.589 . . . . 0.0 111.21 171.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.1 pttp -49.12 -29.28 5.09 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 124.811 1.245 . . . . 0.0 113.124 175.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.402 HD11 ' H ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -68.27 -30.26 47.16 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.161 0 C-N-CA 123.88 0.872 . . . . 0.0 112.316 179.491 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -121.95 -5.85 9.02 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 124.176 0.99 . . . . 0.0 111.462 -173.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -109.38 105.42 14.79 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.007 0.923 . . . . 0.0 108.695 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -83.19 78.1 9.66 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 123.54 0.736 . . . . 0.0 109.101 -176.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 61.1 t80 56.17 80.78 0.14 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.55 1.14 . . . . 0.0 111.185 -173.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -88.82 -18.52 27.49 Favored 'General case' 0 CA--C 1.551 1.002 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 173.506 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 68.97 118.86 0.03 OUTLIER Pre-proline 0 C--N 1.362 1.123 0 C-N-CA 126.001 1.72 . . . . 0.0 110.757 -177.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -50.56 -40.04 55.14 Favored 'Trans proline' 0 C--N 1.386 2.552 0 C-N-CA 123.68 2.92 . . . . 0.0 113.388 -176.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 25.4 ptt180 -141.87 92.5 2.45 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-O 122.105 0.955 . . . . 0.0 110.693 -177.071 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 21.0 p-10 -75.2 124.53 89.32 Favored Pre-proline 0 CA--C 1.542 0.658 0 CA-C-N 114.903 -1.044 . . . . 0.0 108.638 169.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -65.7 -27.71 52.42 Favored 'Trans proline' 0 C--N 1.371 1.735 0 C-N-CA 122.58 2.186 . . . . 0.0 112.305 -177.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -106.75 97.38 7.17 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 108.177 -1.045 . . . . 0.0 108.177 176.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -74.83 110.68 9.32 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 121.342 0.592 . . . . 0.0 110.611 -179.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -81.08 -39.32 25.89 Favored 'General case' 0 C--O 1.242 0.66 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 168.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.8 t70 73.27 143.39 0.07 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.833 1.653 . . . . 0.0 113.251 171.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 30.3 mmt180 -128.42 98.48 5.06 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 113.91 -1.496 . . . . 0.0 107.543 168.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -79.56 54.3 1.74 Allowed 'General case' 0 CA--C 1.549 0.933 0 CA-C-O 122.057 0.932 . . . . 0.0 108.963 168.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 35.3 t -91.52 175.24 6.98 Favored 'General case' 0 C--O 1.241 0.617 0 C-N-CA 124.73 1.212 . . . . 0.0 109.883 -172.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -74.93 161.21 29.71 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-O 121.479 0.657 . . . . 0.0 111.471 176.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 74.6 mtm180 -83.28 -63.79 1.29 Allowed 'General case' 0 C--O 1.239 0.531 0 CA-C-N 114.457 -1.247 . . . . 0.0 109.418 -174.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 25.0 t 62.91 164.42 0.11 Allowed 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 124.727 1.211 . . . . 0.0 112.288 176.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 63.0 t30 64.96 100.03 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.062 0.945 . . . . 0.0 111.185 178.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -81.89 -2.61 51.82 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.059 0.544 . . . . 0.0 112.26 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 44.9 mm-40 -62.9 133.69 55.07 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.347 0.659 . . . . 0.0 111.143 178.049 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 43.8 t -69.19 -48.38 69.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 176.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 34.4 tp 59.57 107.2 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.896 0 O-C-N 125.168 1.543 . . . . 0.0 112.129 174.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -69.86 -10.14 57.38 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.492 0.717 . . . . 0.0 111.843 -178.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -81.63 -6.49 59.05 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.378 0.671 . . . . 0.0 111.593 176.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.467 HD12 HD12 ' A' ' 27' ' ' LEU . 31.8 mt -83.43 136.86 34.15 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 167.714 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -58.68 130.12 50.58 Favored Glycine 0 CA--C 1.534 1.242 0 CA-C-O 119.207 -0.774 . . . . 0.0 112.197 176.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -67.15 -42.21 84.75 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.304 0.642 . . . . 0.0 112.313 -171.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 7.3 p -59.9 -32.09 49.07 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 C-N-CA 122.926 0.491 . . . . 0.0 109.74 173.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.522 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -64.86 -56.69 15.01 Favored Glycine 0 C--O 1.214 -1.104 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.615 174.586 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.441 ' NE2' ' HB2' ' A' ' 58' ' ' LEU . 98.0 mt-30 -58.9 -43.77 91.07 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 125.173 1.389 . . . . 0.0 111.946 -176.631 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -67.28 -49.11 65.57 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.125 -175.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -70.02 -28.9 65.87 Favored 'General case' 0 C--O 1.217 -0.614 0 CA-C-N 114.649 -1.16 . . . . 0.0 110.24 179.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.522 ' HB2' ' O ' ' A' ' 62' ' ' GLY . 11.1 tp -64.24 -44.79 90.74 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.358 1.063 . . . . 0.0 109.551 178.874 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 65.2 ttt180 -74.95 -29.48 60.94 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 114.736 -1.12 . . . . 0.0 110.507 -179.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.57 -41.34 88.72 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.423 0.689 . . . . 0.0 110.247 174.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.537 HG23 ' HB3' ' A' ' 20' ' ' GLN . 95.5 mt -70.56 -37.76 71.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.887 0.875 . . . . 0.0 109.875 175.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -63.24 -36.43 83.62 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.272 0.629 . . . . 0.0 110.268 176.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -75.88 -34.08 59.98 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.906 0.882 . . . . 0.0 111.113 177.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.468 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -69.92 -53.88 15.88 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.441 0.696 . . . . 0.0 110.73 -179.408 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.53 HD22 HD13 ' A' ' 76' ' ' ILE . 95.5 mt -61.78 -31.94 72.19 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.455 1.102 . . . . 0.0 111.249 176.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.53 -49.69 76.54 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 123.615 0.572 . . . . 0.0 110.175 172.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.426 ' HE ' ' HA ' ' A' ' 72' ' ' ALA . 86.8 mtm180 -63.56 -30.9 71.95 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 124.043 0.839 . . . . 0.0 111.844 178.427 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.53 HD13 HD22 ' A' ' 73' ' ' LEU . 66.4 mt -69.24 -43.42 81.37 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 177.019 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.62 -25.23 64.74 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.941 176.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 69.8 m -91.61 -7.55 49.78 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.413 1.085 . . . . 0.0 112.344 178.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 69.33 23.46 76.36 Favored Glycine 0 C--N 1.35 1.325 0 N-CA-C 113.77 0.268 . . . . 0.0 113.77 178.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 9.9 t -129.85 29.34 5.0 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 124.589 1.156 . . . . 0.0 110.449 -179.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -63.97 148.66 49.07 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 121.938 -0.476 . . . . 0.0 110.271 171.573 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.454 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 70.09 37.72 73.07 Favored Glycine 0 C--N 1.342 0.866 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.611 -175.267 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 90.8 m -129.45 124.06 33.13 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.588 0.755 . . . . 0.0 109.448 175.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.425 ' HB3' ' HB2' ' A' ' 87' ' ' CYS . 37.5 t -67.85 108.37 2.97 Favored 'General case' 0 C--N 1.35 0.622 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 169.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 29.2 m -62.34 -28.47 44.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 O-C-N 124.134 0.896 . . . . 0.0 111.167 176.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 38.3 tttm -81.11 -8.04 59.68 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.518 1.127 . . . . 0.0 111.673 -177.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.506 ' HB3' ' HG2' ' A' ' 89' ' ' LYS . 60.8 m -122.07 -24.1 5.22 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.895 0.878 . . . . 0.0 111.696 176.678 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 62.77 46.58 93.35 Favored Glycine 0 CA--C 1.537 1.425 0 O-C-N 123.508 0.505 . . . . 0.0 113.178 -168.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.506 ' HG2' ' HB3' ' A' ' 87' ' ' CYS . 0.0 OUTLIER -159.88 171.17 19.91 Favored 'General case' 0 N--CA 1.498 1.945 0 N-CA-C 112.616 0.598 . . . . 0.0 112.616 -179.103 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.454 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 13.9 tpp180 -64.4 144.11 57.41 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 125.377 1.471 . . . . 0.0 113.192 -172.462 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 26.1 mm -91.73 149.7 4.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 125.179 1.392 . . . . 0.0 108.847 172.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 24.8 m -67.58 140.59 56.94 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 174.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -59.21 -36.54 75.59 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 122.869 0.468 . . . . 0.0 111.209 -178.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -63.96 -36.05 82.68 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.658 0.783 . . . . 0.0 111.267 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.515 ' HD2' ' HB2' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -65.57 -40.71 93.09 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.221 175.45 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 95.2 mt -75.07 -31.74 61.31 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -176.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.2 ptpt -76.03 -28.17 57.61 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 109.827 -0.435 . . . . 0.0 109.827 178.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -83.48 -35.24 25.05 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.671 0.788 . . . . 0.0 111.316 176.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.4 p -158.53 91.9 2.06 Favored Pre-proline 0 CA--C 1.557 1.237 0 C-N-CA 124.536 1.134 . . . . 0.0 109.055 -177.162 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . 0.522 ' HG2' HD23 ' A' ' 16' ' ' LEU . 58.8 Cg_endo -74.06 -28.27 11.12 Favored 'Trans proline' 0 C--N 1.377 2.069 0 C-N-CA 122.639 2.226 . . . . 0.0 113.324 -178.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . 0.451 ' HA ' ' HB3' ' A' ' 72' ' ' ALA . 29.6 p90 -77.96 -2.55 37.51 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -173.407 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.1 t -65.62 116.77 34.82 Favored Pre-proline 0 CA--C 1.563 1.457 0 CA-C-N 117.862 0.301 . . . . 0.0 110.72 -179.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -73.45 -16.51 24.38 Favored 'Trans proline' 0 C--N 1.381 2.259 0 C-N-CA 122.489 2.126 . . . . 0.0 111.474 175.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.454 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 12.7 m-85 -113.11 174.83 5.71 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.421 1.088 . . . . 0.0 110.279 -176.262 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 31.1 p -98.19 173.97 6.75 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.193 0.597 . . . . 0.0 109.812 175.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.515 ' HB2' ' HD2' ' A' ' 95' ' ' ARG . 6.6 tp60 -56.66 -38.94 72.89 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.443 0.697 . . . . 0.0 112.325 -177.042 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -64.24 -48.51 75.52 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.169 0.588 . . . . 0.0 111.404 179.186 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.454 ' HB2' ' HB3' ' A' ' 104' ' ' PHE . 97.0 m -64.85 -36.17 83.47 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.044 0.538 . . . . 0.0 110.91 176.442 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.58 -35.25 78.65 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.824 0.849 . . . . 0.0 110.68 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -77.09 -25.37 52.21 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.784 175.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -90.62 -5.4 55.91 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.743 0.817 . . . . 0.0 112.098 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 108' ' ' CYS . 70.8 mt . . . . . 0 N--CA 1.48 1.066 0 C-N-CA 122.943 0.497 . . . . 0.0 109.665 173.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.527 HD23 ' H1 ' ' A' ' 1' ' ' LEU . 2.4 pt? . . . . . 0 N--CA 1.484 1.23 0 CA-C-O 120.639 0.257 . . . . 0.0 111.202 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -69.2 147.45 51.27 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.842 0.857 . . . . 0.0 111.876 -179.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -154.12 -29.0 0.03 OUTLIER Glycine 0 C--N 1.339 0.721 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.939 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 81.53 -124.09 6.31 Favored Glycine 0 C--N 1.346 1.107 0 CA-C-N 115.506 -0.347 . . . . 0.0 112.775 175.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.553 ' HA ' ' HB ' ' A' ' 9' ' ' VAL . 33.3 mmtp -109.61 0.04 18.9 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.923 0.889 . . . . 0.0 111.783 179.447 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.0 m -69.23 151.26 46.51 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.366 0.666 . . . . 0.0 110.17 173.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 33.9 ttp 70.0 44.66 0.78 Allowed 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 122.231 1.015 . . . . 0.0 109.63 -173.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 58.87 31.92 21.74 Favored 'General case' 0 N--CA 1.485 1.322 0 CA-C-N 114.653 -1.158 . . . . 0.0 113.107 166.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.553 ' HB ' ' HA ' ' A' ' 5' ' ' LYS . 88.6 t -60.93 -28.6 43.81 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 CA-C-O 119.064 -0.493 . . . . 0.0 111.826 -176.222 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -59.5 -49.17 78.81 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 174.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.9 m -58.43 -42.45 87.31 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.891 0.876 . . . . 0.0 110.755 179.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -73.16 -32.45 64.87 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.112 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' A' ' 9' ' ' VAL . 3.3 tm-20 -63.99 -54.19 38.26 Favored 'General case' 0 C--O 1.243 0.728 0 C-N-CA 124.535 1.134 . . . . 0.0 109.984 -177.019 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.674 ' HB2' ' HZ3' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -66.6 -45.0 80.61 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 114.396 -1.275 . . . . 0.0 111.406 -177.254 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 10.8 tt -64.77 -33.4 63.14 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 CA-C-N 118.08 0.4 . . . . 0.0 110.713 -175.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.577 ' HB3' HG21 ' A' ' 69' ' ' ILE . 37.5 mt -65.77 -45.29 83.07 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.348 0.659 . . . . 0.0 111.127 175.497 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.508 ' O ' ' HG3' ' A' ' 21' ' ' ARG . 52.1 mtm180 -62.81 -46.47 87.81 Favored 'General case' 0 C--O 1.214 -0.783 0 O-C-N 123.647 0.592 . . . . 0.0 110.986 177.691 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -56.75 -46.97 81.08 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.686 0.795 . . . . 0.0 111.268 176.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? -66.24 -33.11 75.01 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.269 179.186 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.606 ' HB3' HG23 ' A' ' 69' ' ' ILE . 1.3 pt20 -81.78 -22.14 37.35 Favored 'General case' 0 C--O 1.21 -0.985 0 CA-C-O 118.805 -0.617 . . . . 0.0 110.486 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.508 ' HG3' ' O ' ' A' ' 17' ' ' ARG . 82.4 mtt180 -65.08 -49.21 70.91 Favored 'General case' 0 N--CA 1.484 1.273 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 175.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -65.76 -37.54 86.62 Favored 'General case' 0 C--N 1.355 0.84 0 O-C-N 123.962 0.789 . . . . 0.0 110.676 179.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 71.9 mt -69.21 -41.03 77.62 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 122.803 0.441 . . . . 0.0 111.704 177.264 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -63.16 -53.47 52.81 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.369 0.668 . . . . 0.0 109.817 -177.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -66.45 -26.65 67.3 Favored 'General case' 0 N--CA 1.484 1.263 0 O-C-N 123.204 0.315 . . . . 0.0 111.689 178.221 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 17.4 ttm-85 -65.13 -47.97 75.25 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.536 0.734 . . . . 0.0 111.462 176.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.581 HD22 HD21 ' A' ' 66' ' ' LEU . 4.0 pp -82.19 -30.18 31.07 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-O 120.64 0.257 . . . . 0.0 110.557 -178.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 87.8 m-70 -89.02 20.91 3.36 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.576 0.75 . . . . 0.0 110.958 174.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.5 pttp -49.1 -34.32 13.68 Favored 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 113.891 1.071 . . . . 0.0 113.891 -176.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.488 ' H ' HD12 ' A' ' 30' ' ' ILE . 0.1 OUTLIER -60.99 -42.05 91.49 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.237 0 C-N-CA 123.972 0.909 . . . . 0.0 112.402 177.6 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -102.77 -15.3 16.31 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.581 0.752 . . . . 0.0 111.807 -176.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -115.19 53.15 0.83 Allowed 'General case' 0 N--CA 1.481 1.076 0 CA-C-O 122.635 1.207 . . . . 0.0 108.243 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -80.89 83.57 6.59 Favored 'General case' 0 CA--C 1.55 0.956 0 CA-C-N 113.244 -1.798 . . . . 0.0 111.087 -171.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -150.34 72.34 1.1 Allowed 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.446 1.099 . . . . 0.0 109.197 173.069 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -93.02 -5.05 51.43 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.438 0.695 . . . . 0.0 111.302 179.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -67.97 126.3 92.47 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 123.763 0.825 . . . . 0.0 109.965 -173.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -57.28 95.29 0.06 OUTLIER 'Trans proline' 0 C--N 1.385 2.495 0 C-N-CA 123.503 2.802 . . . . 0.0 112.444 -179.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 31.5 mmt180 58.88 91.89 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.095 1.358 . . . . 0.0 112.42 -177.281 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 -74.23 126.27 89.23 Favored Pre-proline 0 CA--C 1.554 1.119 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 166.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -68.84 -2.29 9.23 Favored 'Trans proline' 0 C--N 1.377 2.036 0 C-N-CA 122.983 2.455 . . . . 0.0 113.07 -175.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -135.59 96.45 3.45 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 170.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -111.93 -130.85 0.31 Allowed 'General case' 0 CA--C 1.551 0.991 0 CA-C-O 118.103 -0.951 . . . . 0.0 109.044 176.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 63.76 27.09 14.61 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 124.33 1.052 . . . . 0.0 109.94 -178.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -133.76 106.65 7.45 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.788 -174.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 4.8 mpt_? -119.42 40.69 3.29 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 170.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.51 74.45 0.77 Allowed 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.216 1.006 . . . . 0.0 111.27 -174.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.9 t -174.6 171.02 3.36 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.567 1.147 . . . . 0.0 109.184 -171.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 71.33 14.17 6.51 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 124.429 1.092 . . . . 0.0 111.428 177.141 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -72.08 -21.64 61.47 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.555 0.742 . . . . 0.0 111.061 178.38 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.3 m -91.01 -76.95 0.43 Allowed 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 172.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.3 t30 59.07 12.16 2.31 Favored 'General case' 0 CA--C 1.568 1.663 0 C-N-CA 124.909 1.284 . . . . 0.0 111.803 178.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -81.27 -33.28 32.8 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.743 0.817 . . . . 0.0 111.021 -171.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -74.91 146.4 41.85 Favored 'General case' 0 C--O 1.243 0.733 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.79 177.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 42.3 t -72.34 -52.6 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.777 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 30.2 tp 68.56 129.41 0.03 OUTLIER 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 125.348 1.459 . . . . 0.0 112.755 175.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -86.16 -11.59 52.14 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 124.049 0.94 . . . . 0.0 112.3 -178.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -81.62 3.85 23.72 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.437 0.695 . . . . 0.0 111.904 -178.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.437 HD12 HD11 ' A' ' 27' ' ' LEU . 11.1 mt -86.74 155.21 20.43 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 174.816 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -86.83 135.77 13.5 Favored Glycine 0 N--CA 1.467 0.723 0 CA-C-O 119.153 -0.804 . . . . 0.0 111.1 173.184 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -56.89 -51.7 68.05 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.441 1.097 . . . . 0.0 111.811 -176.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.5 t -65.34 -33.87 66.62 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 124.133 0.973 . . . . 0.0 110.117 178.212 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.601 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -64.43 -39.96 97.35 Favored Glycine 0 C--O 1.217 -0.927 0 O-C-N 123.487 0.492 . . . . 0.0 111.94 177.474 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -75.66 -38.37 58.84 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.373 1.069 . . . . 0.0 111.484 -178.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -80.75 -36.58 31.77 Favored 'General case' 0 N--CA 1.485 1.316 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.094 -173.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -69.85 -36.08 75.24 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 173.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.601 ' HB2' ' O ' ' A' ' 62' ' ' GLY . 9.5 tp -57.86 -47.57 82.35 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.168 0.987 . . . . 0.0 109.839 171.796 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 38.8 ttt180 -56.92 -44.17 82.17 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.864 1.265 . . . . 0.0 111.193 177.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.8 -38.19 88.3 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.579 0.752 . . . . 0.0 110.749 179.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.606 HG23 ' HB3' ' A' ' 20' ' ' GLN . 74.6 mt -65.78 -50.65 69.37 Favored 'Isoleucine or valine' 0 C--N 1.351 0.647 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.332 177.217 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -68.92 -28.75 66.95 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.176 0.991 . . . . 0.0 111.617 -176.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.32 -44.91 77.99 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.469 0.707 . . . . 0.0 109.621 175.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.492 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -64.48 -45.78 85.86 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 114.76 -1.109 . . . . 0.0 110.633 177.257 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.545 HD23 HD12 ' A' ' 76' ' ' ILE . 92.6 mt -64.16 -34.28 77.7 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 124.479 1.112 . . . . 0.0 111.636 179.041 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.59 -42.17 98.47 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 123.985 0.803 . . . . 0.0 109.947 176.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 58.3 mtp85 -74.72 -25.43 59.12 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 114.804 -1.089 . . . . 0.0 111.881 178.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.545 HD12 HD23 ' A' ' 73' ' ' LEU . 47.6 mt -67.82 -44.93 85.15 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 CA-C-N 118.662 0.664 . . . . 0.0 109.957 175.077 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.34 -39.21 89.74 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 124.085 0.866 . . . . 0.0 110.379 174.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 27.5 t -78.3 -10.72 59.79 Favored 'General case' 0 CA--C 1.555 1.164 0 CA-C-N 115.074 -0.966 . . . . 0.0 111.725 179.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 77.0 10.22 86.37 Favored Glycine 0 C--N 1.351 1.411 0 N-CA-C 113.765 0.266 . . . . 0.0 113.765 178.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 7.5 t -117.87 27.98 8.69 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 124.724 1.21 . . . . 0.0 111.08 -179.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.452 ' HE1' ' HB1' ' A' ' 72' ' ' ALA . 80.1 t80 -53.43 149.14 8.01 Favored 'General case' 0 N--CA 1.485 1.313 0 O-C-N 121.901 -0.499 . . . . 0.0 111.867 170.58 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.532 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 69.52 41.83 75.05 Favored Glycine 0 C--O 1.212 -1.253 0 CA-C-N 114.619 -1.173 . . . . 0.0 111.149 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' THR . . . . . 0.408 HG21 ' HB2' ' A' ' 1' ' ' LEU . 31.5 m -124.82 108.75 12.26 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-O 121.265 0.555 . . . . 0.0 109.629 176.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 51.4 t -62.52 98.6 0.12 Allowed 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 114.366 -1.288 . . . . 0.0 110.659 172.085 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 27.5 m -63.65 -23.71 34.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 O-C-N 124.381 1.05 . . . . 0.0 112.374 -175.019 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.482 ' HD3' ' HB3' ' A' ' 108' ' ' CYS . 47.0 tttm -67.76 -26.32 66.06 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.453 0.701 . . . . 0.0 112.046 -177.281 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 31.9 p -133.52 4.25 3.64 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 122.614 0.366 . . . . 0.0 111.648 179.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 61.08 28.42 68.9 Favored Glycine 0 C--N 1.351 1.395 0 N-CA-C 114.483 0.553 . . . . 0.0 114.483 -179.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 46.9 mtmt -116.38 166.27 12.26 Favored 'General case' 0 N--CA 1.487 1.404 0 CA-C-N 117.238 0.519 . . . . 0.0 110.67 -177.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.532 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 7.2 tpp180 -67.21 146.63 54.0 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 124.517 1.127 . . . . 0.0 111.116 177.078 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 10.5 mm -85.77 144.27 9.87 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 170.155 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 5.4 m -67.94 142.19 56.09 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 109.049 -0.722 . . . . 0.0 109.049 176.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -62.29 -29.14 70.22 Favored 'General case' 0 N--CA 1.484 1.272 0 CA-C-N 118.294 0.497 . . . . 0.0 109.976 174.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -57.0 -52.96 63.17 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.534 1.134 . . . . 0.0 111.248 169.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.57 -35.51 80.75 Favored 'General case' 0 C--O 1.214 -0.809 0 O-C-N 124.296 0.997 . . . . 0.0 110.011 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 89.4 mt -72.69 -40.39 66.26 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.467 0.707 . . . . 0.0 111.841 -179.288 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.566 ' HB3' ' HZ3' ' A' ' 97' ' ' LYS . 0.3 OUTLIER -75.01 -28.29 60.46 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.362 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.32 -43.5 50.5 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.973 0.909 . . . . 0.0 110.842 173.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.3 p -151.85 99.73 2.92 Favored Pre-proline 0 CA--C 1.554 1.098 0 C-N-CA 124.6 1.16 . . . . 0.0 108.876 -177.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -66.65 -24.87 47.5 Favored 'Trans proline' 0 C--N 1.373 1.86 0 C-N-CA 122.789 2.326 . . . . 0.0 113.434 179.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 28.4 p90 -93.36 54.63 2.11 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.134 0.974 . . . . 0.0 110.677 -178.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 4.1 t -112.76 103.52 55.61 Favored Pre-proline 0 CA--C 1.554 1.1 0 C-N-CA 123.434 0.694 . . . . 0.0 110.696 -179.066 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -76.26 -9.48 19.02 Favored 'Trans proline' 0 C--N 1.376 1.976 0 C-N-CA 122.852 2.368 . . . . 0.0 112.215 168.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -127.08 117.17 21.9 Favored 'General case' 0 C--N 1.359 1.005 0 C-N-CA 123.501 0.721 . . . . 0.0 110.31 -174.085 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 16.7 p -64.09 159.22 20.81 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 118.145 -0.931 . . . . 0.0 109.28 175.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -44.91 -39.38 5.39 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 124.313 1.045 . . . . 0.0 113.493 -169.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -58.09 -53.79 54.22 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.155 0.982 . . . . 0.0 111.217 176.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.482 ' HB3' ' HD3' ' A' ' 86' ' ' LYS . 85.0 m -73.4 -31.88 64.13 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 114.759 -1.109 . . . . 0.0 111.754 -176.376 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.9 -38.91 92.55 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.127 0.971 . . . . 0.0 110.507 176.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.75 -30.19 62.65 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.489 0.716 . . . . 0.0 110.876 174.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -79.42 -6.1 56.12 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.822 0.849 . . . . 0.0 112.453 -179.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 73.1 mt . . . . . 0 C--O 1.249 1.074 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 174.473 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.558 ' H2 ' HD23 ' A' ' 1' ' ' LEU . 2.1 pt? . . . . . 0 N--CA 1.474 0.772 0 N-CA-C 109.684 -0.488 . . . . 0.0 109.684 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -90.96 142.37 27.84 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.288 0.635 . . . . 0.0 109.398 174.235 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 176.39 113.39 0.34 Allowed Glycine 0 C--N 1.34 0.766 0 N-CA-C 111.755 -0.538 . . . . 0.0 111.755 -178.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -84.69 99.82 2.33 Favored Glycine 0 C--N 1.345 1.076 0 N-CA-C 110.851 -0.9 . . . . 0.0 110.851 174.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.14 -45.7 90.27 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.032 0.933 . . . . 0.0 110.245 -178.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.8 m 66.39 -74.9 0.06 Allowed 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 125.366 1.466 . . . . 0.0 110.631 178.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 21.3 ptp -78.32 173.53 12.21 Favored 'General case' 0 C--O 1.242 0.69 0 C-N-CA 124.284 1.034 . . . . 0.0 110.534 175.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -77.66 79.33 4.16 Favored 'General case' 0 C--O 1.241 0.651 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 174.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 60.5 t -67.72 -33.94 64.8 Favored 'Isoleucine or valine' 0 C--N 1.347 0.482 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.225 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -65.34 -30.22 71.04 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 123.836 0.71 . . . . 0.0 111.697 179.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 47.5 m -65.88 -44.23 85.94 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 122.708 0.403 . . . . 0.0 110.061 173.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -67.95 -35.19 77.98 Favored 'General case' 0 C--O 1.217 -0.634 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.51 176.219 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.9 tm-20 -63.59 -55.31 24.77 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.299 1.039 . . . . 0.0 109.41 -176.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.418 ' HB2' ' HE3' ' A' ' 14' ' ' LYS . 15.4 ptmt -71.03 -35.46 71.99 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.252 -173.562 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.493 ' O ' ' HB2' ' A' ' 19' ' ' ARG . 12.3 tt -65.87 -33.95 67.02 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.551 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.555 ' HB3' HG21 ' A' ' 69' ' ' ILE . 69.6 mt -75.58 -34.05 60.64 Favored 'General case' 0 C--N 1.355 0.824 0 C-N-CA 123.952 0.901 . . . . 0.0 111.587 176.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.444 ' NH2' HD13 ' A' ' 73' ' ' LEU . 3.6 mmp_? -58.15 -49.91 75.35 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.097 0.559 . . . . 0.0 109.803 174.665 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -74.95 -27.93 60.38 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.02 0.528 . . . . 0.0 111.381 -179.01 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.493 ' HB2' ' O ' ' A' ' 15' ' ' ILE . 2.3 tpt180 -71.3 -41.98 69.26 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 123.622 0.577 . . . . 0.0 110.101 -178.217 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.56 ' HB3' HG23 ' A' ' 69' ' ' ILE . 2.5 pt20 -72.22 -30.35 64.83 Favored 'General case' 0 C--O 1.206 -1.22 0 CA-C-O 118.834 -0.603 . . . . 0.0 109.665 177.094 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.521 ' HB3' HH21 ' A' ' 25' ' ' ARG . 60.7 mtm-85 -68.43 -46.37 70.06 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.019 0.528 . . . . 0.0 111.999 179.66 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -63.58 -38.24 90.38 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 123.463 0.477 . . . . 0.0 110.428 177.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.553 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 81.5 mt -64.66 -48.77 73.57 Favored 'General case' 0 C--O 1.21 -0.981 0 O-C-N 123.495 0.497 . . . . 0.0 109.927 173.141 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.486 ' CE1' HD22 ' A' ' 66' ' ' LEU . 1.7 m-85 -57.41 -46.38 83.55 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.083 0.953 . . . . 0.0 110.871 -174.196 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.521 HH21 ' HB3' ' A' ' 21' ' ' ARG . 11.0 ptp180 -71.94 -28.11 63.24 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 122.747 0.419 . . . . 0.0 111.321 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 38.8 ttm180 -68.39 -56.52 8.21 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.435 0.694 . . . . 0.0 111.265 175.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.553 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 3.5 pp -80.88 -25.93 37.25 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.386 0.674 . . . . 0.0 111.51 -171.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.532 ' HB3' ' HG2' ' A' ' 31' ' ' GLU . 75.6 m-70 -86.63 34.55 0.65 Allowed 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 122.866 0.466 . . . . 0.0 110.109 169.676 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 20.8 pttp -50.7 -30.66 14.31 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 125.376 1.47 . . . . 0.0 112.398 170.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.422 ' H ' HD11 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -69.78 -24.86 27.27 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.186 0 C-N-CA 123.834 0.854 . . . . 0.0 112.673 -178.15 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.532 ' HG2' ' HB3' ' A' ' 28' ' ' HIS . 10.5 pt-20 -105.58 -20.99 13.3 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.931 0.493 . . . . 0.0 110.377 173.393 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -78.41 112.58 15.59 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 179.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -75.57 -80.24 0.09 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.478 0.711 . . . . 0.0 110.904 -172.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -150.28 48.38 0.9 Allowed 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.662 0.785 . . . . 0.0 110.252 -177.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -83.47 -24.82 31.61 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.142 174.03 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 71.71 112.0 0.03 OUTLIER Pre-proline 0 CA--C 1.557 1.233 0 C-N-CA 125.493 1.517 . . . . 0.0 110.021 -172.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -62.52 105.02 0.39 Allowed 'Trans proline' 0 C--N 1.386 2.551 0 C-N-CA 123.141 2.561 . . . . 0.0 111.769 177.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 75.9 mtt180 -112.72 154.59 25.92 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.723 0.809 . . . . 0.0 110.765 -177.457 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -85.73 161.82 49.41 Favored Pre-proline 0 CA--C 1.556 1.198 0 C-N-CA 123.856 0.863 . . . . 0.0 109.392 175.229 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -65.71 87.85 0.22 Allowed 'Trans proline' 0 C--N 1.377 2.05 0 C-N-CA 122.668 2.245 . . . . 0.0 113.733 179.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -107.0 15.18 25.59 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.814 0.845 . . . . 0.0 108.957 163.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -85.01 162.48 19.34 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.255 1.422 . . . . 0.0 110.003 178.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -59.2 -73.93 0.08 Allowed 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.082 0.553 . . . . 0.0 110.293 173.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 28.0 t70 178.76 86.74 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.159 0.984 . . . . 0.0 109.837 -178.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 7.2 mpt_? -120.85 156.03 32.82 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.558 0.743 . . . . 0.0 109.67 171.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -94.98 15.68 18.14 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.943 0.897 . . . . 0.0 112.2 -177.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.6 m -62.93 97.66 0.11 Allowed 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 124.308 1.043 . . . . 0.0 112.012 -173.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -102.65 159.46 15.44 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.632 1.173 . . . . 0.0 112.181 -170.198 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 34.5 mmm-85 -128.91 44.32 2.99 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.475 1.11 . . . . 0.0 108.197 170.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.5 m -65.61 -74.4 0.11 Allowed 'General case' 0 C--N 1.352 0.676 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.652 -172.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 56.1 t30 58.87 110.76 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.49 1.116 . . . . 0.0 111.792 -179.491 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -75.79 79.31 2.72 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.023 0.929 . . . . 0.0 111.016 -176.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -159.21 154.47 25.42 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.417 1.487 . . . . 0.0 108.605 169.01 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 47.0 t -90.92 -86.81 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 CA-C-O 118.779 -0.629 . . . . 0.0 109.337 178.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.43 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 54.6 tp 69.12 133.92 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 124.972 1.309 . . . . 0.0 110.116 -171.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -74.17 -3.33 29.14 Favored 'General case' 0 N--CA 1.492 1.625 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -175.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -88.09 20.03 3.37 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 123.64 0.776 . . . . 0.0 111.867 -179.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.468 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 50.0 mt -85.95 -85.06 0.16 Allowed 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 110.516 -0.179 . . . . 0.0 110.516 174.718 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 151.07 139.75 3.05 Favored Glycine 0 C--N 1.346 1.1 0 CA-C-O 119.711 -0.494 . . . . 0.0 111.889 -178.532 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -57.2 -63.89 1.07 Allowed 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.774 1.23 . . . . 0.0 113.18 -170.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 60.4 t -59.82 -33.81 53.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 C-N-CA 124.39 1.076 . . . . 0.0 110.759 -177.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.525 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -63.68 -54.96 27.81 Favored Glycine 0 C--O 1.215 -1.082 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.766 177.232 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -67.87 -37.42 81.79 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 124.363 1.065 . . . . 0.0 112.092 -174.058 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -67.81 -46.07 72.96 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 123.901 0.75 . . . . 0.0 110.472 -179.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -70.17 -35.08 73.74 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.1 178.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.525 ' HB2' ' O ' ' A' ' 62' ' ' GLY . 11.9 tp -60.3 -46.3 90.36 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 124.943 1.297 . . . . 0.0 110.459 -179.306 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -66.64 -39.74 88.41 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 124.632 1.207 . . . . 0.0 110.674 178.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.03 -39.99 95.32 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.673 0.789 . . . . 0.0 110.849 179.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.56 HG23 ' HB3' ' A' ' 20' ' ' GLN . 89.4 mt -66.87 -46.03 86.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-N 114.841 -1.072 . . . . 0.0 109.745 176.361 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -65.03 -33.12 75.28 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.063 0.945 . . . . 0.0 111.271 -177.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.58 -44.07 75.18 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.626 0.77 . . . . 0.0 110.275 178.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.423 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -63.45 -49.97 71.56 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.893 178.573 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.444 HD13 ' NH2' ' A' ' 17' ' ' ARG . 69.1 mt -61.23 -38.24 85.93 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.805 1.242 . . . . 0.0 112.246 179.038 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.55 -42.54 98.99 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.423 0.689 . . . . 0.0 110.485 177.338 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 86.8 mtt-85 -75.24 -21.85 58.29 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 114.761 -1.109 . . . . 0.0 112.369 -178.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.44 HD13 HD21 ' A' ' 73' ' ' LEU . 89.6 mt -67.24 -47.82 80.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 171.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -67.2 -30.64 70.64 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.362 178.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 29.1 t -80.48 -23.6 40.06 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.652 0.781 . . . . 0.0 111.113 177.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 87.99 7.29 74.29 Favored Glycine 0 C--N 1.35 1.333 0 C-N-CA 123.039 0.352 . . . . 0.0 113.657 -178.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.3 t -113.12 29.03 8.31 Favored 'General case' 0 CA--C 1.556 1.2 0 C-N-CA 124.082 0.953 . . . . 0.0 110.413 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -64.22 146.12 54.83 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 122.729 0.412 . . . . 0.0 110.413 169.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.485 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 74.36 31.32 59.28 Favored Glycine 0 C--N 1.341 0.842 0 O-C-N 123.82 0.7 . . . . 0.0 112.298 -177.748 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 26.6 m -117.89 110.85 18.25 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 122.887 0.475 . . . . 0.0 110.215 176.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.436 ' HA ' ' O ' ' A' ' 103' ' ' PRO . 44.0 t -77.57 95.64 4.59 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.154 0.981 . . . . 0.0 110.101 174.728 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 30.9 m -62.56 -30.77 49.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 O-C-N 124.138 0.898 . . . . 0.0 113.077 -175.44 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.527 ' HD2' ' HB3' ' A' ' 108' ' ' CYS . 22.7 ttmm -60.56 -32.19 71.28 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.439 0.696 . . . . 0.0 112.535 -176.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.539 ' SG ' ' HB2' ' A' ' 89' ' ' LYS . 28.7 p -119.83 1.73 11.02 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 122.45 0.3 . . . . 0.0 111.273 175.342 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 62.76 20.82 62.38 Favored Glycine 0 C--N 1.351 1.39 0 CA-C-O 120.065 -0.297 . . . . 0.0 113.388 -177.069 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.539 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 11.0 mmpt? -106.46 177.06 4.97 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.48 0.712 . . . . 0.0 110.534 -176.689 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.485 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 21.8 tpp85 -78.83 144.97 34.53 Favored 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 124.197 0.999 . . . . 0.0 110.415 177.409 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 5.3 mm -79.94 144.89 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 168.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 19.7 m -74.55 149.31 40.23 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 110.403 -0.221 . . . . 0.0 110.403 178.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.428 ' HG2' ' HE3' ' A' ' 97' ' ' LYS . 30.6 tt0 -60.07 -42.96 95.68 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.854 0.862 . . . . 0.0 110.598 174.09 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -57.21 -43.7 83.03 Favored 'General case' 0 N--CA 1.482 1.151 0 O-C-N 124.497 1.123 . . . . 0.0 110.546 176.414 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.524 ' HG3' HG23 ' A' ' 102' ' ' THR . 26.5 tpt180 -64.43 -43.37 94.54 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 114.488 -1.233 . . . . 0.0 110.869 179.074 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 75.2 mt -71.46 -33.68 69.54 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.302 0.641 . . . . 0.0 112.624 -176.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.428 ' HE3' ' HG2' ' A' ' 93' ' ' GLU . 16.4 ptpt -79.75 -27.74 40.51 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 122.248 -0.283 . . . . 0.0 110.56 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -80.34 -33.66 37.22 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.859 0.864 . . . . 0.0 111.21 177.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.4 p -157.57 97.04 1.98 Allowed Pre-proline 0 CA--C 1.556 1.197 0 C-N-CA 124.78 1.232 . . . . 0.0 108.248 179.187 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . 0.422 ' HG2' HD22 ' A' ' 16' ' ' LEU . 64.5 Cg_endo -75.28 -8.81 20.06 Favored 'Trans proline' 0 C--N 1.377 2.067 0 C-N-CA 122.671 2.248 . . . . 0.0 113.724 -179.342 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 35.1 p90 -105.74 45.6 0.96 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.434 0.693 . . . . 0.0 110.991 -178.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.524 HG23 ' HG3' ' A' ' 95' ' ' ARG . 15.2 t -116.92 101.79 53.28 Favored Pre-proline 0 CA--C 1.564 1.508 0 CA-C-O 121.149 0.5 . . . . 0.0 110.216 -178.56 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.436 ' O ' ' HA ' ' A' ' 84' ' ' CYS . 32.4 Cg_exo -64.83 -24.54 61.22 Favored 'Trans proline' 0 C--N 1.378 2.109 0 C-N-CA 122.898 2.399 . . . . 0.0 113.317 174.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.403 ' HA ' ' SG ' ' A' ' 84' ' ' CYS . 6.6 m-85 -114.64 148.74 37.71 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.833 0.853 . . . . 0.0 109.297 -178.694 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.502 ' SG ' ' OE1' ' A' ' 107' ' ' GLU . 28.5 p -83.54 165.7 18.87 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 -178.482 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -46.78 -41.86 16.06 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 124.793 1.237 . . . . 0.0 114.204 -162.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.502 ' OE1' ' SG ' ' A' ' 105' ' ' CYS . 0.0 OUTLIER -82.95 -23.61 33.37 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-O 120.647 0.261 . . . . 0.0 111.556 -175.982 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.527 ' HB3' ' HD2' ' A' ' 86' ' ' LYS . 97.7 m -76.54 -29.83 56.87 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.23 1.012 . . . . 0.0 110.951 174.288 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -78.13 -34.57 49.84 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.505 0.722 . . . . 0.0 109.866 174.46 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.55 -21.72 61.12 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.874 0.87 . . . . 0.0 111.151 174.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -73.57 -26.79 60.99 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.778 0.831 . . . . 0.0 111.733 176.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.512 HD21 ' HE3' ' A' ' 86' ' ' LYS . 88.2 mt . . . . . 0 CA--C 1.553 1.085 0 C-N-CA 123.877 0.871 . . . . 0.0 110.623 -178.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 10.1 mp . . . . . 0 N--CA 1.478 0.943 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 77.82 -24.9 0.21 Allowed 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 125.835 1.654 . . . . 0.0 113.206 178.537 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 73.22 1.42 56.84 Favored Glycine 0 C--N 1.349 1.273 0 CA-C-O 119.658 -0.523 . . . . 0.0 113.76 -178.337 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 80.39 -57.12 4.69 Favored Glycine 0 C--N 1.355 1.589 0 C-N-CA 123.287 0.47 . . . . 0.0 112.733 -173.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.05 -169.46 3.26 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.018 0.927 . . . . 0.0 109.64 -175.035 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.1 t 71.11 -172.52 0.16 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.332 1.053 . . . . 0.0 111.768 169.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' MET . . . . . 0.404 ' HG2' ' HE2' ' A' ' 12' ' ' TYR . 60.2 ttp -58.31 -62.25 1.98 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.33 1.052 . . . . 0.0 110.685 178.561 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 62.6 t30 57.68 103.49 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 125.689 1.596 . . . . 0.0 112.547 178.41 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 99.4 t -59.4 -34.0 53.0 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.079 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.145 177.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -58.4 -43.81 88.76 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 124.465 1.106 . . . . 0.0 112.249 -179.294 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.9 m -57.68 -40.38 79.29 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.031 0.532 . . . . 0.0 110.262 177.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.469 ' HA ' HG22 ' A' ' 15' ' ' ILE . 25.2 m-85 -75.62 -34.81 60.59 Favored 'General case' 0 C--O 1.214 -0.799 0 CA-C-N 115.1 -0.955 . . . . 0.0 110.816 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -57.53 -53.23 60.45 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.407 1.083 . . . . 0.0 110.089 -177.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.479 ' HZ1' ' HB2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -71.72 -42.75 66.93 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.711 -176.701 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.469 HG22 ' HA ' ' A' ' 12' ' ' TYR . 11.6 tt -62.92 -34.25 65.11 Favored 'Isoleucine or valine' 0 C--N 1.37 1.489 0 CA-C-N 118.588 0.631 . . . . 0.0 110.083 -177.13 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.569 ' HB3' HG21 ' A' ' 69' ' ' ILE . 56.9 mt -65.13 -43.2 92.69 Favored 'General case' 0 C--N 1.345 0.406 0 C-N-CA 123.224 0.609 . . . . 0.0 110.898 175.827 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.411 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 97.4 mtt180 -63.87 -47.46 80.57 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 123.717 0.636 . . . . 0.0 111.88 177.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -63.71 -42.57 97.93 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 122.976 0.51 . . . . 0.0 111.204 -178.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -39.97 81.05 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.786 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.627 ' HB3' HG23 ' A' ' 69' ' ' ILE . 2.2 pt20 -70.16 -35.37 73.96 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 119.301 -0.381 . . . . 0.0 110.535 -178.706 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 71.1 mtp180 -69.47 -41.5 76.12 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.588 0.755 . . . . 0.0 111.363 -175.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -66.68 -34.41 77.81 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 175.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.592 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 86.1 mt -69.42 -38.53 77.94 Favored 'General case' 0 C--O 1.216 -0.671 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.924 174.763 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -60.85 -46.31 91.09 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 122.992 0.517 . . . . 0.0 110.304 -177.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 -69.95 -31.52 69.3 Favored 'General case' 0 N--CA 1.483 1.197 0 O-C-N 123.492 0.495 . . . . 0.0 110.634 178.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.417 ' O ' ' HE3' ' A' ' 29' ' ' LYS . 21.7 ttt85 -62.38 -59.48 4.94 Favored 'General case' 0 C--N 1.361 1.091 0 C-N-CA 123.533 0.733 . . . . 0.0 111.439 177.191 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 1.1 pp -80.19 -24.48 40.28 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 112.505 0.558 . . . . 0.0 112.505 -173.36 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -91.26 28.04 1.76 Allowed 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 123.04 0.536 . . . . 0.0 109.693 174.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.417 ' HE3' ' O ' ' A' ' 26' ' ' ARG . 7.6 ptpp? -49.53 -30.55 8.62 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 125.265 1.426 . . . . 0.0 113.484 -178.535 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -62.85 -36.3 74.93 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 123.864 0.866 . . . . 0.0 112.206 -177.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -106.07 -25.82 11.89 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.915 0.886 . . . . 0.0 110.733 -178.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -91.95 107.48 19.24 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.873 0.869 . . . . 0.0 110.009 -174.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -69.61 -22.55 63.49 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 123.451 0.7 . . . . 0.0 110.499 174.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -76.32 95.28 3.74 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.661 0.784 . . . . 0.0 110.245 174.337 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -78.02 -61.17 2.08 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 167.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 60.02 93.74 0.05 OUTLIER Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 125.422 1.489 . . . . 0.0 112.321 177.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -72.03 -158.59 0.06 OUTLIER 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 122.775 2.317 . . . . 0.0 111.697 173.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -70.52 93.66 0.92 Allowed 'General case' 0 N--CA 1.481 1.096 0 CA-C-O 121.486 0.66 . . . . 0.0 110.76 -178.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -114.32 149.12 41.57 Favored Pre-proline 0 CA--C 1.541 0.598 0 C-N-CA 124.314 1.046 . . . . 0.0 108.433 174.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_exo -58.96 -51.92 6.01 Favored 'Trans proline' 0 C--N 1.373 1.821 0 C-N-CA 122.332 2.021 . . . . 0.0 110.915 171.188 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.1 t70 64.98 166.92 0.17 Allowed 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 125.046 1.339 . . . . 0.0 110.927 -178.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -87.53 -44.95 10.89 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.032 0.533 . . . . 0.0 110.872 178.557 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -176.34 -37.08 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.646 1.178 . . . . 0.0 110.414 179.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 55.5 t0 65.4 110.47 0.03 OUTLIER 'General case' 0 C--N 1.356 0.857 0 C-N-CA 125.482 1.513 . . . . 0.0 110.298 -167.178 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 21.5 ttp180 -134.4 5.15 3.46 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 124.575 1.15 . . . . 0.0 108.904 176.476 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -91.08 -29.67 17.19 Favored 'General case' 0 C--N 1.356 0.884 0 C-N-CA 123.481 0.713 . . . . 0.0 111.301 -176.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.6 p -70.32 88.33 0.64 Allowed 'General case' 0 C--N 1.36 1.027 0 CA-C-O 122.141 0.972 . . . . 0.0 110.392 177.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.598 ' HG3' ' HG3' ' A' ' 49' ' ' ARG . 7.6 pt-20 -96.16 -161.5 0.87 Allowed 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 113.951 -1.477 . . . . 0.0 109.664 177.185 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.598 ' HG3' ' HG3' ' A' ' 48' ' ' GLU . 95.3 mtt180 72.46 117.42 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 125.219 1.408 . . . . 0.0 111.724 173.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 34.8 p -83.7 116.21 22.55 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 169.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -68.59 96.32 0.7 Allowed 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.115 0.566 . . . . 0.0 111.263 -178.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -69.74 -35.97 75.45 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.103 172.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -66.41 131.83 46.94 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.277 171.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 33.8 t -91.49 -70.54 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 170.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.465 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 37.4 tp 61.84 106.57 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.594 1.158 . . . . 0.0 110.239 -177.2 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -68.14 13.23 0.09 Allowed 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 114.883 1.438 . . . . 0.0 114.883 -168.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -77.65 -2.61 36.84 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.051 0.54 . . . . 0.0 111.048 168.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 8.8 mt -72.93 136.06 45.14 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 170.5 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -70.3 149.08 46.68 Favored Glycine 0 N--CA 1.472 1.087 0 CA-C-O 119.227 -0.763 . . . . 0.0 112.45 -177.234 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -50.72 -60.31 3.18 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.725 1.21 . . . . 0.0 112.51 -175.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.414 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 12.4 p -56.81 -35.03 44.95 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 123.202 0.601 . . . . 0.0 111.377 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -67.86 -41.13 88.98 Favored Glycine 0 C--N 1.347 1.165 0 O-C-N 123.883 0.739 . . . . 0.0 112.665 177.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -68.87 -43.78 74.64 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.629 0.771 . . . . 0.0 110.695 -177.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -68.2 -33.09 73.78 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.588 0.755 . . . . 0.0 110.749 178.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.414 ' HB2' ' O ' ' A' ' 61' ' ' VAL . 2.7 tp10 -69.79 -46.75 65.05 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.609 179.608 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.7 mp -60.59 -39.44 88.1 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 124.356 1.035 . . . . 0.0 110.47 174.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 74.0 ttt180 -64.24 -39.61 94.31 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.311 -179.124 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.19 -43.11 65.02 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.921 0.889 . . . . 0.0 110.985 178.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.627 HG23 ' HB3' ' A' ' 20' ' ' GLN . 69.9 mt -64.5 -55.86 19.22 Favored 'Isoleucine or valine' 0 C--N 1.356 0.855 0 C-N-CA 123.507 0.723 . . . . 0.0 110.174 -177.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -66.71 -25.29 66.45 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.089 0.955 . . . . 0.0 112.304 -179.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.403 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -65.17 -51.93 58.09 Favored 'General case' 0 N--CA 1.482 1.175 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 171.07 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.516 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -60.43 -42.42 96.03 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.317 1.047 . . . . 0.0 111.007 -179.042 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.474 HD22 HD13 ' A' ' 76' ' ' ILE . 88.1 mt -64.19 -39.41 93.94 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 124.56 1.144 . . . . 0.0 111.619 178.537 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.12 -37.66 88.17 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.383 0.673 . . . . 0.0 110.558 175.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.403 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 69.6 mtt-85 -73.05 -26.44 61.29 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.701 0.8 . . . . 0.0 111.055 178.494 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 72' ' ' ALA . 90.0 mt -66.33 -48.76 79.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 174.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.62 -35.17 80.04 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.909 179.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.8 t -78.19 -14.94 59.25 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 123.794 0.837 . . . . 0.0 111.437 177.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 82.23 6.19 88.99 Favored Glycine 0 C--N 1.351 1.385 0 C-N-CA 123.24 0.448 . . . . 0.0 113.908 177.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.5 t -104.28 15.17 28.87 Favored 'General case' 0 CA--C 1.555 1.172 0 C-N-CA 124.311 1.045 . . . . 0.0 111.323 -177.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -67.16 151.85 46.81 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 169.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 72.29 20.58 79.3 Favored Glycine 0 C--N 1.344 1.009 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.775 -176.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 30.5 m -128.12 111.37 13.4 Favored 'General case' 0 C--N 1.353 0.742 0 C-N-CA 124.179 0.992 . . . . 0.0 109.65 178.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 44.2 t -72.71 93.18 1.62 Allowed 'General case' 0 C--O 1.244 0.769 0 C-N-CA 123.878 0.871 . . . . 0.0 110.094 173.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 25.6 m -61.07 -24.4 32.97 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 CA-C-N 114.438 -1.255 . . . . 0.0 112.843 -178.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 47.7 tttm -71.9 -14.79 62.04 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.055 0.542 . . . . 0.0 112.116 -176.204 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.477 ' SG ' ' HB2' ' A' ' 89' ' ' LYS . 27.7 p -137.11 5.57 2.79 Favored 'General case' 0 N--CA 1.486 1.374 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 173.322 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 65.04 17.2 63.07 Favored Glycine 0 C--N 1.357 1.728 0 N-CA-C 113.819 0.288 . . . . 0.0 113.819 -178.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.477 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 31.8 mmmt -101.34 165.19 11.4 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.756 0.822 . . . . 0.0 109.415 -179.028 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 25.6 mmt180 -80.41 149.6 30.1 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 123.001 0.521 . . . . 0.0 110.42 172.079 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 5.3 mm -78.16 145.62 9.5 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 172.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 17.2 m -75.21 151.39 38.45 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.127 0.571 . . . . 0.0 109.744 177.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -64.25 -41.06 97.12 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 122.624 0.37 . . . . 0.0 110.672 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.452 ' HA ' ' HG2' ' A' ' 97' ' ' LYS . 24.7 m-20 -71.44 -31.71 67.51 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 123.771 0.67 . . . . 0.0 111.213 -179.465 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 29.0 tpt180 -64.02 -37.17 86.44 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.433 0.693 . . . . 0.0 110.588 170.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 55.6 mt -77.68 -40.91 39.96 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.175 0.59 . . . . 0.0 112.278 -178.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.452 ' HG2' ' HA ' ' A' ' 94' ' ' ASP . 15.2 ptpt -70.79 -27.61 64.04 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-O 120.757 0.313 . . . . 0.0 110.223 -177.295 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.7 -50.69 8.99 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.693 0.797 . . . . 0.0 110.755 173.234 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -130.2 86.0 55.34 Favored Pre-proline 0 CA--C 1.558 1.275 0 C-N-CA 124.087 0.955 . . . . 0.0 108.724 -175.449 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -77.89 -7.15 16.37 Favored 'Trans proline' 0 C--N 1.37 1.707 0 C-N-CA 122.383 2.055 . . . . 0.0 114.077 -177.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 16.3 p90 -103.12 -8.63 20.34 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -176.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 15.1 t -73.5 125.28 90.74 Favored Pre-proline 0 CA--C 1.56 1.331 0 CA-C-N 117.896 0.316 . . . . 0.0 110.398 -175.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -79.15 -7.91 15.25 Favored 'Trans proline' 0 C--N 1.371 1.724 0 C-N-CA 122.517 2.145 . . . . 0.0 111.98 172.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -116.32 140.08 49.71 Favored 'General case' 0 C--N 1.353 0.723 0 C-N-CA 123.855 0.862 . . . . 0.0 110.281 -175.157 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 20.6 p -75.43 167.09 22.56 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 174.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -50.55 -41.49 54.19 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.798 0.839 . . . . 0.0 112.106 -174.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -65.48 -44.27 87.64 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.2 1.0 . . . . 0.0 110.396 -175.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.405 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 86.8 m -69.26 -39.34 78.49 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.23 0.612 . . . . 0.0 111.103 177.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.88 -30.99 71.68 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.576 0.75 . . . . 0.0 111.399 177.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -74.46 -34.69 63.21 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.893 0.877 . . . . 0.0 110.598 174.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -77.02 -14.38 59.84 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 123.881 0.872 . . . . 0.0 111.939 178.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 108' ' ' CYS . 94.5 mt . . . . . 0 N--CA 1.479 0.996 0 CA-C-O 118.237 -0.887 . . . . 0.0 109.426 172.214 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.608 HD13 ' H3 ' ' A' ' 1' ' ' LEU . 7.4 mp . . . . . 0 N--CA 1.476 0.866 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 65.64 -88.16 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 125.258 1.423 . . . . 0.0 112.305 -179.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 72.99 -80.84 0.69 Allowed Glycine 0 C--N 1.346 1.131 0 N-CA-C 111.824 -0.51 . . . . 0.0 111.824 -173.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 70.64 -112.08 4.09 Favored Glycine 0 C--N 1.353 1.518 0 CA-C-O 119.692 -0.505 . . . . 0.0 112.932 178.391 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 65.6 mttm 63.32 -164.39 0.25 Allowed 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 124.977 1.311 . . . . 0.0 112.675 175.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.7 p -59.5 -32.51 70.35 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.079 0.951 . . . . 0.0 111.498 173.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 56.8 ttp -156.1 134.43 11.49 Favored 'General case' 0 C--O 1.242 0.676 0 C-N-CA 124.454 1.102 . . . . 0.0 108.282 176.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 15.9 p-10 -70.86 81.65 0.64 Allowed 'General case' 0 CA--C 1.548 0.874 0 CA-C-O 121.9 0.857 . . . . 0.0 110.273 176.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 42.5 t -69.69 -27.56 34.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.485 -179.302 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -52.98 -38.49 62.24 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.073 0.949 . . . . 0.0 111.695 179.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 16.6 m -60.42 -43.48 96.71 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.932 175.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -72.18 -32.69 67.05 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.996 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.52 ' HG2' HD11 ' A' ' 76' ' ' ILE . 39.5 mt-10 -59.3 -56.25 24.44 Favored 'General case' 0 N--CA 1.492 1.636 0 CA-C-O 121.434 0.635 . . . . 0.0 110.809 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -66.47 -44.44 82.71 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.134 -176.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 10.3 tt -67.49 -32.7 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.242 0 C-N-CA 122.514 0.326 . . . . 0.0 110.574 -174.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.527 ' HB3' HG21 ' A' ' 69' ' ' ILE . 31.2 mt -65.2 -46.09 82.15 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.093 0.557 . . . . 0.0 110.635 175.103 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 51.2 mtm-85 -63.82 -41.91 97.77 Favored 'General case' 0 C--O 1.217 -0.628 0 O-C-N 123.605 0.566 . . . . 0.0 110.81 179.402 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -61.54 -36.27 80.1 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.317 0.647 . . . . 0.0 111.218 177.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -81.15 -28.84 34.89 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.258 -178.535 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.588 ' HB3' HG23 ' A' ' 69' ' ' ILE . 2.4 pt20 -78.04 -25.09 47.62 Favored 'General case' 0 C--O 1.207 -1.16 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 173.546 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 72.9 mtt180 -66.82 -49.48 65.67 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.056 0.542 . . . . 0.0 110.589 176.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -65.75 -37.46 86.42 Favored 'General case' 0 N--CA 1.478 0.968 0 O-C-N 123.533 0.521 . . . . 0.0 110.88 178.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.581 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 58.0 mt -67.96 -46.23 71.97 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 119.155 -0.45 . . . . 0.0 111.147 175.411 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.422 ' O ' ' HB2' ' A' ' 28' ' ' HIS . 3.8 m-85 -58.13 -50.53 73.18 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.173 0.589 . . . . 0.0 110.094 -177.579 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 19.7 ptt180 -68.79 -28.15 66.51 Favored 'General case' 0 N--CA 1.48 1.057 0 O-C-N 123.525 0.515 . . . . 0.0 111.172 -178.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.453 ' O ' ' HE3' ' A' ' 29' ' ' LYS . 14.8 ttm180 -62.97 -59.05 5.35 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.083 0.553 . . . . 0.0 110.403 175.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.581 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 1.6 pp -80.99 -8.37 59.76 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.986 -176.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.446 ' HB3' ' HG2' ' A' ' 31' ' ' GLU . 17.9 m170 -112.11 53.76 0.72 Allowed 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 170.83 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.453 ' HE3' ' O ' ' A' ' 26' ' ' ARG . 5.1 ptpp? -72.06 -19.59 61.8 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.012 -177.201 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.524 HD13 ' HG3' ' A' ' 57' ' ' GLU . 0.2 OUTLIER -61.87 -38.41 80.53 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.204 0.602 . . . . 0.0 111.525 175.421 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.446 ' HG2' ' HB3' ' A' ' 28' ' ' HIS . 12.7 pt-20 -94.4 -28.82 15.31 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.093 0.557 . . . . 0.0 110.32 178.261 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -89.02 75.36 7.98 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 122.002 0.906 . . . . 0.0 109.179 174.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -92.29 13.8 18.24 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 114.256 -1.338 . . . . 0.0 110.744 -177.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 27.1 t80 68.08 29.73 6.18 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 124.938 1.295 . . . . 0.0 109.871 -172.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -94.01 11.1 30.89 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.515 1.126 . . . . 0.0 109.827 169.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -64.53 155.16 82.23 Favored Pre-proline 0 CA--C 1.552 1.056 0 C-N-CA 125.422 1.489 . . . . 0.0 111.325 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.406 ' HG3' ' HB2' ' A' ' 44' ' ' ASP . 15.9 Cg_endo -54.77 123.77 14.56 Favored 'Trans proline' 0 C--N 1.382 2.292 0 C-N-CA 122.803 2.335 . . . . 0.0 112.116 177.653 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 42.0 mtp180 -65.92 -30.5 71.1 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.634 0.773 . . . . 0.0 111.24 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -78.99 118.71 74.01 Favored Pre-proline 0 CA--C 1.547 0.829 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 170.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -63.7 103.55 0.4 Allowed 'Trans proline' 0 C--N 1.378 2.099 0 C-N-CA 122.948 2.432 . . . . 0.0 112.714 -171.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -133.92 148.39 51.2 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 174.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 56.1 m-20 -83.08 -27.54 30.15 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.212 0.605 . . . . 0.0 112.139 -172.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -125.3 -30.7 3.12 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.387 0.675 . . . . 0.0 111.546 -171.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.406 ' HB2' ' HG3' ' A' ' 37' ' ' PRO . 24.5 t70 58.23 -84.68 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.562 1.145 . . . . 0.0 110.721 -171.813 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 42.7 ttp180 171.83 71.33 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.297 1.839 . . . . 0.0 106.295 177.466 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -159.06 90.06 0.96 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.073 -177.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 31.4 p -151.43 -61.93 0.18 Allowed 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 175.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.554 ' HG2' ' HG3' ' A' ' 49' ' ' ARG . 28.9 tt0 64.39 -81.88 0.03 OUTLIER 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 124.811 1.244 . . . . 0.0 112.32 172.717 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.554 ' HG3' ' HG2' ' A' ' 48' ' ' GLU . 24.5 mtp180 -130.42 -174.18 3.27 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 124.327 1.051 . . . . 0.0 110.66 -173.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 27.6 m -66.0 124.78 23.47 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 123.884 0.873 . . . . 0.0 112.037 -176.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -131.95 107.4 8.67 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.162 0.985 . . . . 0.0 108.845 174.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -118.56 70.76 0.82 Allowed 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 178.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -99.64 103.51 15.21 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.13 176.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 97.6 t -77.37 -71.27 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 173.046 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 96.1 mt 75.34 164.87 0.27 Allowed 'General case' 0 N--CA 1.489 1.525 0 C-N-CA 125.761 1.624 . . . . 0.0 112.05 -174.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -92.55 17.29 10.33 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 122.431 1.11 . . . . 0.0 109.392 170.046 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.524 ' HG3' HD13 ' A' ' 30' ' ' ILE . 0.6 OUTLIER -83.97 -13.01 54.42 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 126.203 1.801 . . . . 0.0 110.164 -175.207 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.447 ' HA ' ' HB2' ' A' ' 27' ' ' LEU . 4.6 mt -94.38 160.83 14.49 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.402 -165.51 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -97.53 161.71 21.36 Favored Glycine 0 N--CA 1.478 1.452 0 CA-C-O 119.493 -0.615 . . . . 0.0 112.181 173.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -64.77 -64.3 0.91 Allowed 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.231 0.612 . . . . 0.0 111.722 -173.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 9.3 p -59.32 -29.76 42.64 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 C-N-CA 123.89 0.876 . . . . 0.0 110.726 177.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.518 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -60.45 -51.73 56.96 Favored Glycine 0 C--N 1.348 1.25 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.164 175.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -69.9 -40.72 75.45 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.714 0.806 . . . . 0.0 112.024 -177.307 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -67.04 -44.05 81.19 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 123.92 0.763 . . . . 0.0 110.264 -174.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -70.43 -38.44 74.57 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.235 177.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' A' ' 62' ' ' GLY . 14.9 tp -58.23 -46.26 86.22 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 124.738 1.215 . . . . 0.0 111.137 178.525 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 31.1 ttt180 -75.94 -31.84 59.28 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 114.004 -1.453 . . . . 0.0 110.024 -175.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -68.28 -39.35 82.17 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 123.915 0.759 . . . . 0.0 110.717 174.533 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.588 HG23 ' HB3' ' A' ' 20' ' ' GLN . 80.9 mt -63.51 -47.7 90.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.523 0.729 . . . . 0.0 109.569 175.46 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -63.37 -35.59 80.91 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.813 -179.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.15 -39.99 75.02 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.757 0.823 . . . . 0.0 110.971 177.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.494 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -68.1 -43.3 78.78 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.61 0.764 . . . . 0.0 110.746 -179.699 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 84.7 mt -61.38 -39.11 89.46 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.288 1.035 . . . . 0.0 111.164 175.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.61 -37.12 86.49 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.624 175.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 67.3 mtt85 -69.98 -29.04 66.03 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.599 0.76 . . . . 0.0 111.509 176.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.52 HD11 ' HG2' ' A' ' 13' ' ' GLU . 62.3 mt -70.3 -44.79 77.3 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 177.394 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.89 -27.41 67.48 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 115.329 -0.851 . . . . 0.0 111.218 176.513 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.9 t -84.13 -18.23 37.46 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.729 0.812 . . . . 0.0 110.804 174.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 82.42 7.94 86.91 Favored Glycine 0 C--N 1.348 1.229 0 C-N-CA 123.084 0.373 . . . . 0.0 113.937 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.2 t -112.95 31.32 6.49 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 124.196 0.998 . . . . 0.0 110.402 -179.029 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -64.5 146.55 54.39 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.714 170.509 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.47 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 73.16 37.03 55.76 Favored Glycine 0 C--N 1.343 0.933 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.955 -177.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 41.0 m -121.73 116.27 24.21 Favored 'General case' 0 C--O 1.242 0.679 0 C-N-CA 123.279 0.632 . . . . 0.0 109.668 177.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 44.4 t -67.33 102.29 1.07 Allowed 'General case' 0 C--N 1.349 0.563 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 169.076 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 33.7 m -63.43 -30.28 49.39 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 O-C-N 124.242 0.964 . . . . 0.0 111.947 -177.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -73.66 -13.7 61.03 Favored 'General case' 0 CA--C 1.557 1.241 0 C-N-CA 123.609 0.763 . . . . 0.0 111.432 177.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 57.5 m -111.17 -23.29 10.96 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.768 0.827 . . . . 0.0 111.534 175.038 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 64.56 20.87 66.34 Favored Glycine 0 CA--C 1.537 1.464 0 CA-C-N 116.545 -0.298 . . . . 0.0 112.986 -165.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 46.6 mtmt -126.89 -177.56 4.07 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.978 0.911 . . . . 0.0 110.491 -172.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.47 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 18.7 tpp180 -72.9 152.67 41.34 Favored 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 124.663 1.185 . . . . 0.0 111.658 -178.192 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 17.6 mm -92.72 149.68 4.11 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.017 0 C-N-CA 124.978 1.311 . . . . 0.0 109.406 170.371 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.3 m -64.59 145.13 56.61 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 122.965 0.506 . . . . 0.0 110.25 174.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -58.5 -42.81 88.51 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.257 0.623 . . . . 0.0 110.839 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.492 ' HA ' ' HG2' ' A' ' 97' ' ' LYS . 16.2 m-20 -68.31 -33.11 73.73 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.83 -179.659 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.405 ' HG3' HG23 ' A' ' 102' ' ' THR . 24.6 tpt180 -68.35 -31.78 71.42 Favored 'General case' 0 CA--C 1.547 0.864 0 O-C-N 123.635 0.584 . . . . 0.0 110.217 173.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 90.9 mt -80.34 -37.06 33.21 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 118.189 0.45 . . . . 0.0 112.171 179.447 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.492 ' HG2' ' HA ' ' A' ' 94' ' ' ASP . 16.5 ptpt -75.32 -28.66 59.74 Favored 'General case' 0 N--CA 1.485 1.296 0 CA-C-O 120.882 0.373 . . . . 0.0 110.077 -177.514 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -91.37 -41.37 10.94 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.721 0.809 . . . . 0.0 111.296 178.736 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 3.8 t -132.54 76.04 72.49 Favored Pre-proline 0 CA--C 1.56 1.357 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 -175.516 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -74.02 0.9 7.77 Favored 'Trans proline' 0 C--N 1.373 1.84 0 C-N-CA 122.579 2.186 . . . . 0.0 114.123 -174.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 22.8 p90 -108.18 -8.61 15.72 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.445 0.698 . . . . 0.0 112.599 -176.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.405 HG23 ' HG3' ' A' ' 95' ' ' ARG . 14.7 t -65.62 123.18 83.91 Favored Pre-proline 0 CA--C 1.566 1.578 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -170.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -76.47 -19.23 15.05 Favored 'Trans proline' 0 C--N 1.377 2.05 0 C-N-CA 122.482 2.121 . . . . 0.0 112.041 171.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -113.02 162.93 15.32 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.848 0.859 . . . . 0.0 109.766 -176.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 31.1 p -92.32 168.38 11.35 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 175.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -55.13 -32.46 62.09 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.618 0.767 . . . . 0.0 111.905 -178.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -67.74 -45.29 75.4 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.757 0.823 . . . . 0.0 109.917 178.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 91.6 m -69.65 -30.61 68.34 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.411 177.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.0 -32.4 74.1 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.419 0.688 . . . . 0.0 110.772 173.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -80.79 -21.16 41.2 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.588 0.755 . . . . 0.0 111.3 173.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -105.06 21.38 17.2 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.745 0.818 . . . . 0.0 112.47 -178.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 90.3 mt . . . . . 0 N--CA 1.484 1.261 0 C-N-CA 123.28 0.632 . . . . 0.0 109.997 175.324 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.603 ' H2 ' HD13 ' A' ' 1' ' ' LEU . 6.6 mp . . . . . 0 N--CA 1.481 1.091 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -86.66 128.5 35.01 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.173 0.589 . . . . 0.0 109.886 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -170.98 169.16 42.25 Favored Glycine 0 C--N 1.346 1.1 0 O-C-N 123.071 0.232 . . . . 0.0 112.832 178.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 79.32 27.47 55.22 Favored Glycine 0 C--N 1.345 1.063 0 CA-C-O 119.718 -0.49 . . . . 0.0 114.09 175.144 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -75.67 -56.56 4.57 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 117.539 0.669 . . . . 0.0 109.341 172.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 26.7 m -102.98 -60.59 1.52 Allowed 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 168.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 89.5 mtp -148.18 -53.81 0.2 Allowed 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.701 1.2 . . . . 0.0 108.257 174.409 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 16.4 m120 59.77 77.09 0.33 Allowed 'General case' 0 C--N 1.352 0.712 0 C-N-CA 124.788 1.235 . . . . 0.0 109.054 -168.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 44.3 t -65.24 -26.04 38.71 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-N 114.35 -1.295 . . . . 0.0 111.795 -170.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -61.87 -31.02 71.26 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.351 0.66 . . . . 0.0 112.572 179.353 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.4 m -66.96 -40.24 87.44 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 121.395 0.617 . . . . 0.0 109.869 172.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -72.64 -30.24 64.14 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.749 178.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.485 ' HG2' HD12 ' A' ' 76' ' ' ILE . 41.2 mt-10 -66.49 -52.44 45.97 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 122.95 0.5 . . . . 0.0 110.385 -179.254 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -65.39 -41.56 93.58 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 123.938 0.774 . . . . 0.0 111.687 -176.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 12.0 tt -65.0 -34.82 73.2 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 CA-C-O 120.727 0.298 . . . . 0.0 110.281 -178.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.5 mt -69.24 -38.26 78.4 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 122.77 0.428 . . . . 0.0 111.119 176.161 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -58.83 -50.41 74.09 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.005 0.522 . . . . 0.0 110.268 175.276 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -61.35 -47.9 83.76 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.451 0.7 . . . . 0.0 111.669 -179.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.77 -40.69 98.08 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.452 0.701 . . . . 0.0 111.404 -178.203 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.578 ' HB3' HG21 ' A' ' 69' ' ' ILE . 3.0 pt20 -76.05 -32.34 59.26 Favored 'General case' 0 C--O 1.214 -0.815 0 CA-C-O 119.045 -0.502 . . . . 0.0 111.432 -177.698 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.0 mmt180 -76.24 -36.01 58.71 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 117.97 0.35 . . . . 0.0 111.365 -176.024 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -67.93 -41.19 82.96 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 174.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.507 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 75.6 mt -65.5 -43.02 91.47 Favored 'General case' 0 C--N 1.354 0.78 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.391 174.39 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -58.36 -54.0 51.98 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.862 0.865 . . . . 0.0 110.702 -175.561 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.9 ptt180 -69.11 -27.61 65.73 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 123.742 0.651 . . . . 0.0 111.224 -178.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 44.0 ttt85 -66.23 -58.32 5.65 Favored 'General case' 0 C--N 1.362 1.11 0 C-N-CA 122.919 0.488 . . . . 0.0 111.269 176.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.608 HD23 HD21 ' A' ' 66' ' ' LEU . 4.0 pp -72.76 -26.52 61.58 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 122.86 0.464 . . . . 0.0 111.022 -175.611 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 42.9 m-70 -84.8 31.75 0.53 Allowed 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.095 0.558 . . . . 0.0 111.376 173.012 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 17.9 pttp -57.45 -18.2 17.15 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 124.414 1.086 . . . . 0.0 113.646 175.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.426 ' H ' HD12 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -64.33 -43.67 97.16 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 CA-C-O 118.907 -0.568 . . . . 0.0 112.294 177.653 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -119.12 -22.9 7.01 Favored 'General case' 0 N--CA 1.499 2.003 0 CA-C-N 119.185 0.902 . . . . 0.0 112.385 -179.473 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -84.55 138.46 32.74 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 122.73 0.412 . . . . 0.0 110.295 -177.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -125.81 155.95 40.31 Favored 'General case' 0 C--O 1.241 0.658 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.7 174.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -127.74 45.75 2.68 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 167.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -63.59 -44.18 94.79 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 114.863 -1.062 . . . . 0.0 109.668 178.106 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -92.78 130.91 35.05 Favored Pre-proline 0 CA--C 1.551 0.985 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.659 173.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -65.35 94.1 0.24 Allowed 'Trans proline' 0 C--N 1.376 1.986 0 C-N-CA 123.307 2.671 . . . . 0.0 112.247 174.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.8 mmm180 -89.36 148.48 23.49 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 173.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.587 ' HB2' ' HB2' ' A' ' 42' ' ' ASP . 62.7 m-20 -73.74 160.01 83.05 Favored Pre-proline 0 CA--C 1.56 1.346 0 C-N-CA 123.169 0.588 . . . . 0.0 110.102 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -54.09 -49.37 17.28 Favored 'Trans proline' 0 C--N 1.383 2.37 0 C-N-CA 123.009 2.473 . . . . 0.0 113.179 -178.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -103.42 18.31 22.1 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 115.0 -1.0 . . . . 0.0 111.278 -178.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.587 ' HB2' ' HB2' ' A' ' 39' ' ' ASN . 22.0 t70 -60.08 -33.0 71.48 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 123.658 0.783 . . . . 0.0 110.834 178.627 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -56.44 -26.31 53.26 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.138 0.975 . . . . 0.0 111.843 175.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 25.2 t70 66.41 -80.6 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.086 1.355 . . . . 0.0 109.831 -179.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 18.5 ttm180 -149.24 51.87 0.96 Allowed 'General case' 0 C--O 1.238 0.497 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 174.237 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.64 127.79 33.79 Favored 'General case' 0 C--O 1.246 0.897 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.182 178.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.8 p -53.93 110.66 0.62 Allowed 'General case' 0 CA--C 1.548 0.874 0 O-C-N 124.261 0.975 . . . . 0.0 110.39 -178.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -72.19 98.03 2.07 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.57 0.748 . . . . 0.0 109.218 -173.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -62.53 112.25 2.39 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 114.48 -1.236 . . . . 0.0 112.091 -167.008 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.2 m -72.08 122.33 20.76 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.248 1.019 . . . . 0.0 110.702 -176.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -113.28 109.74 19.23 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 175.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -73.32 -23.15 60.22 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.113 0.965 . . . . 0.0 111.641 -175.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -93.57 148.78 21.78 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.546 0.739 . . . . 0.0 109.928 178.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 59.4 t -68.52 -49.44 65.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 O-C-N 123.758 0.661 . . . . 0.0 109.654 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 40.6 tp 65.49 109.7 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 124.868 1.267 . . . . 0.0 111.632 178.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -67.41 -19.56 65.41 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.117 0.967 . . . . 0.0 111.735 -177.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -74.56 -8.26 55.78 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.357 0.663 . . . . 0.0 112.55 -177.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.44 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 59.8 mt -77.73 -73.36 0.31 Allowed 'General case' 0 CA--C 1.546 0.82 0 O-C-N 123.087 0.242 . . . . 0.0 110.597 178.355 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 129.7 124.7 2.65 Favored Glycine 0 N--CA 1.474 1.227 0 N-CA-C 111.375 -0.69 . . . . 0.0 111.375 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -66.05 -38.19 87.73 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -164.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 6.1 p -62.36 -39.4 84.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 CA-C-N 118.399 0.545 . . . . 0.0 110.692 177.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.477 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -66.39 -49.89 53.66 Favored Glycine 0 C--N 1.344 0.98 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.632 176.463 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -67.23 -35.72 80.14 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 124.593 1.157 . . . . 0.0 112.24 -174.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -73.11 -48.69 33.52 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.577 -176.063 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -64.96 -34.57 78.73 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 115.013 -0.994 . . . . 0.0 109.74 177.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.608 HD21 HD23 ' A' ' 27' ' ' LEU . 13.9 tp -60.84 -46.02 92.23 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.691 1.197 . . . . 0.0 109.911 175.517 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 51.7 ttt180 -61.92 -38.09 87.12 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.172 0.989 . . . . 0.0 110.93 -178.469 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.16 -43.26 99.17 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 123.81 0.694 . . . . 0.0 110.253 176.093 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.578 HG21 ' HB3' ' A' ' 20' ' ' GLN . 85.1 mt -65.2 -45.49 93.69 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.871 179.076 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -66.14 -33.09 74.98 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.912 0.885 . . . . 0.0 111.123 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.58 -35.89 73.28 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.093 0.957 . . . . 0.0 110.243 177.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.429 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -68.44 -47.28 67.59 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.64 177.348 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.491 HD22 HD13 ' A' ' 76' ' ' ILE . 88.2 mt -63.24 -33.76 76.19 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 124.192 0.997 . . . . 0.0 111.491 177.115 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.0 -41.24 95.57 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.667 0.787 . . . . 0.0 110.355 175.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 89.1 mtm180 -68.82 -30.43 68.97 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.382 0.673 . . . . 0.0 111.604 176.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.491 HD13 HD22 ' A' ' 73' ' ' LEU . 75.1 mt -68.99 -42.63 82.22 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 176.499 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.53 -34.25 77.81 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.767 176.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.8 t -82.0 -12.79 58.14 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 124.035 0.934 . . . . 0.0 111.114 178.268 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 75.71 9.64 84.88 Favored Glycine 0 C--N 1.353 1.521 0 C-N-CA 123.086 0.375 . . . . 0.0 113.627 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 15.2 t -112.42 28.18 9.0 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.24 1.016 . . . . 0.0 109.774 -177.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.415 ' HE1' ' HB2' ' A' ' 72' ' ' ALA . 58.8 t80 -66.45 144.41 56.51 Favored 'General case' 0 C--N 1.348 0.527 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.901 172.291 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.535 ' HA2' HD22 ' A' ' 96' ' ' LEU . . . 77.87 37.27 30.12 Favored Glycine 0 C--N 1.34 0.77 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.769 -172.256 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 93.9 m -123.79 118.26 26.77 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.557 0.743 . . . . 0.0 110.586 177.181 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 48.8 t -62.02 92.85 0.04 OUTLIER 'General case' 0 C--N 1.352 0.699 0 C-N-CA 124.927 1.291 . . . . 0.0 108.239 166.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 33.1 m -62.88 -27.33 42.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 124.003 0.921 . . . . 0.0 112.25 -173.211 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.656 ' HE3' ' HA ' ' A' ' 112' ' ' LEU . 59.4 tttm -70.48 -20.63 62.85 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.25 1.02 . . . . 0.0 111.573 178.681 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 11.8 m -120.48 -13.54 8.79 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 123.959 0.903 . . . . 0.0 111.342 -174.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 60.83 31.6 76.42 Favored Glycine 0 C--N 1.353 1.473 0 CA-C-N 116.48 -0.327 . . . . 0.0 113.266 -173.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -135.74 -174.49 3.67 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.761 0.824 . . . . 0.0 110.691 -176.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.465 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 4.3 tpp180 -74.7 151.93 39.17 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.854 0.862 . . . . 0.0 112.918 -169.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 23.9 mm -95.48 148.85 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 124.345 1.058 . . . . 0.0 108.513 167.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.4 m -71.75 145.46 48.74 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.643 0.777 . . . . 0.0 110.05 177.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -58.32 -41.03 83.65 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.245 0.618 . . . . 0.0 110.929 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -62.55 -38.97 92.11 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.324 1.05 . . . . 0.0 111.101 179.318 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.4 ' HE ' HG22 ' A' ' 102' ' ' THR . 25.5 tpt180 -69.66 -33.46 72.62 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.74 178.604 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.535 HD22 ' HA2' ' A' ' 82' ' ' GLY . 87.0 mt -73.17 -45.23 57.77 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 122.817 0.447 . . . . 0.0 111.421 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -71.32 -28.46 64.11 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 122.808 0.443 . . . . 0.0 110.938 -175.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -88.34 -47.16 8.6 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.336 0.654 . . . . 0.0 111.058 178.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 1.7 t -129.87 79.66 72.81 Favored Pre-proline 0 CA--C 1.559 1.308 0 C-N-CA 124.029 0.931 . . . . 0.0 108.639 -175.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -73.37 -8.17 21.45 Favored 'Trans proline' 0 C--N 1.372 1.774 0 C-N-CA 122.285 1.99 . . . . 0.0 113.445 -177.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 26.6 p90 -100.86 -8.69 22.35 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -176.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.4 HG22 ' HE ' ' A' ' 95' ' ' ARG . 13.8 t -62.06 122.17 70.57 Favored Pre-proline 0 CA--C 1.563 1.443 0 O-C-N 123.129 0.268 . . . . 0.0 111.365 -172.152 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -66.44 -37.85 21.75 Favored 'Trans proline' 0 C--N 1.376 2.026 0 C-N-CA 122.461 2.107 . . . . 0.0 111.371 173.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -99.57 -179.49 4.22 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.694 -178.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.752 ' SG ' ' HB2' ' A' ' 108' ' ' CYS . 15.0 p -98.71 179.64 4.6 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 124.875 1.27 . . . . 0.0 109.227 173.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -64.86 -55.51 19.04 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 118.051 0.387 . . . . 0.0 111.459 -177.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.06 -34.25 76.08 Favored 'General case' 0 N--CA 1.483 1.225 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -175.068 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.752 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 68.3 m -81.04 -22.95 38.91 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 179.433 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -78.74 -24.23 44.94 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 171.439 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -81.87 -27.4 33.5 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.605 0.762 . . . . 0.0 110.797 172.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -131.51 78.19 1.81 Allowed 'General case' 0 C--O 1.242 0.677 0 C-N-CA 124.137 0.975 . . . . 0.0 109.959 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.656 ' HA ' ' HE3' ' A' ' 86' ' ' LYS . 73.7 mt . . . . . 0 CA--C 1.551 1.017 0 CA-C-N 114.677 -1.147 . . . . 0.0 109.89 175.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 41.8 t30 . . . . . 0 N--CA 1.479 1.017 0 CA-C-O 120.621 0.248 . . . . 0.0 110.837 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 59.8 t -59.25 -35.7 59.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 124.039 0.936 . . . . 0.0 112.113 -174.56 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -56.51 -43.31 79.64 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.361 0.664 . . . . 0.0 111.601 -174.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.8 m -58.17 -43.8 87.65 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 123.989 0.806 . . . . 0.0 110.798 178.541 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.518 ' HA ' HG22 ' A' ' 15' ' ' ILE . 36.6 m-85 -74.24 -37.22 63.86 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.989 -176.675 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -57.59 -51.31 70.0 Favored 'General case' 0 C--O 1.244 0.802 0 C-N-CA 124.823 1.249 . . . . 0.0 110.497 -177.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.415 ' NZ ' ' HB2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -71.49 -42.45 68.03 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.276 -0.875 . . . . 0.0 111.568 -177.661 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.518 HG22 ' HA ' ' A' ' 12' ' ' TYR . 9.2 tt -67.68 -28.52 42.02 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 CA-C-N 118.474 0.579 . . . . 0.0 110.723 -177.959 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 42.1 mt -63.12 -47.41 82.93 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.299 0.64 . . . . 0.0 110.27 172.492 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.52 ' O ' ' HG3' ' A' ' 21' ' ' ARG . 48.2 mtm105 -62.57 -42.56 99.62 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 123.953 0.783 . . . . 0.0 111.229 176.186 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -59.74 -45.4 92.31 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 122.889 0.476 . . . . 0.0 110.198 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? -67.28 -42.11 84.34 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.776 -177.599 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.67 ' HB3' HG21 ' A' ' 69' ' ' ILE . 3.2 pt20 -71.13 -36.0 71.93 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-O 118.82 -0.609 . . . . 0.0 110.531 -174.621 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.52 ' HG3' ' O ' ' A' ' 17' ' ' ARG . 53.7 mtp180 -75.67 -39.6 57.33 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 123.791 0.682 . . . . 0.0 111.934 -173.27 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -64.2 -40.02 95.2 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 123.459 0.475 . . . . 0.0 109.869 174.71 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.508 ' HB2' HD11 ' A' ' 66' ' ' LEU . 98.8 mt -72.78 -29.82 63.6 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.44 175.93 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.434 ' HB2' ' HA ' ' A' ' 21' ' ' ARG . 1.4 m-85 -65.5 -54.79 23.29 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.478 0.711 . . . . 0.0 109.498 178.64 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -66.35 -27.29 67.77 Favored 'General case' 0 N--CA 1.482 1.164 0 O-C-N 123.939 0.774 . . . . 0.0 110.758 -177.511 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -58.77 -52.76 64.35 Favored 'General case' 0 C--N 1.356 0.882 0 O-C-N 124.077 0.86 . . . . 0.0 110.695 173.244 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 3.2 pp -87.32 -11.79 48.43 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 31.0 m170 . . . . . 0 N--CA 1.491 1.606 0 C-N-CA 123.866 0.866 . . . . 0.0 110.835 175.704 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.501 ' HB2' ' NE2' ' A' ' 63' ' ' GLN . 18.1 mt . . . . . 0 C--O 1.241 0.628 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -59.4 124.98 38.15 Favored Glycine 0 C--N 1.353 1.492 0 CA-C-O 118.808 -0.995 . . . . 0.0 111.521 177.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -62.49 -32.71 73.66 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 123.552 0.741 . . . . 0.0 112.22 -174.388 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.434 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 8.7 p -62.84 -39.04 83.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 123.251 0.62 . . . . 0.0 110.156 174.318 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -73.23 -43.11 40.3 Favored Glycine 0 C--N 1.348 1.198 0 O-C-N 123.686 0.616 . . . . 0.0 111.969 179.121 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.501 ' NE2' ' HB2' ' A' ' 58' ' ' LEU . 99.4 mt-30 -59.89 -45.34 92.84 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.028 0.931 . . . . 0.0 110.725 177.87 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -67.7 -40.57 84.31 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.121 0.968 . . . . 0.0 110.474 -178.622 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.434 ' HB2' ' O ' ' A' ' 61' ' ' VAL . 3.1 tp10 -65.15 -42.1 94.1 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.624 178.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.508 HD11 ' HB2' ' A' ' 23' ' ' LEU . 0.8 OUTLIER -70.31 -29.97 66.84 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.693 1.197 . . . . 0.0 111.35 179.927 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 41.9 ttt180 -69.4 -38.69 78.07 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 123.856 0.722 . . . . 0.0 109.665 175.32 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.85 -37.55 76.17 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.675 0.79 . . . . 0.0 111.038 177.045 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.67 HG21 ' HB3' ' A' ' 20' ' ' GLN . 98.7 mt -68.95 -40.29 80.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 123.61 0.764 . . . . 0.0 110.016 175.303 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -66.74 -39.21 87.86 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.7 0.8 . . . . 0.0 110.17 -178.667 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.58 -41.85 92.42 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.632 0.773 . . . . 0.0 110.493 176.787 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.433 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -65.28 -45.82 82.9 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.874 0.869 . . . . 0.0 111.186 179.463 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.498 HD23 HD12 ' A' ' 76' ' ' ILE . 80.5 mt -65.53 -31.99 73.34 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.161 0.984 . . . . 0.0 111.222 177.278 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.6 -34.07 69.56 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.479 0.712 . . . . 0.0 110.951 177.58 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -65.38 -36.19 83.22 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.006 0.522 . . . . 0.0 110.213 172.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.498 HD12 HD23 ' A' ' 73' ' ' LEU . 55.8 mt -66.68 -43.7 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 177.424 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.83 -30.44 71.49 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.533 1.133 . . . . 0.0 111.539 175.175 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.9 t -85.07 -17.27 37.92 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.833 0.853 . . . . 0.0 111.115 177.109 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 82.15 13.29 79.37 Favored Glycine 0 C--N 1.347 1.188 0 C-N-CA 123.412 0.53 . . . . 0.0 113.549 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 12.4 t -125.14 33.39 5.18 Favored 'General case' 0 CA--C 1.556 1.18 0 C-N-CA 124.176 0.99 . . . . 0.0 110.718 -177.266 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -62.84 144.32 56.72 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 121.91 -0.494 . . . . 0.0 110.087 165.589 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.21 31.06 32.34 Favored Glycine 0 C--N 1.341 0.848 0 O-C-N 123.965 0.791 . . . . 0.0 111.359 -171.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.7 m -130.46 114.55 15.67 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.717 0.807 . . . . 0.0 110.203 175.34 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 44.1 t -61.13 106.16 0.57 Allowed 'General case' 0 C--N 1.351 0.667 0 C-N-CA 124.101 0.96 . . . . 0.0 109.131 170.567 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 26.8 m -59.09 -31.01 44.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 O-C-N 124.236 0.96 . . . . 0.0 110.995 177.107 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 36.0 tttm -80.22 -7.56 59.04 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.084 0.953 . . . . 0.0 111.624 -176.051 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 62.8 m -119.83 -24.25 6.2 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 124.023 0.929 . . . . 0.0 111.91 174.7 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 65.04 27.8 72.74 Favored Glycine 0 CA--C 1.537 1.461 0 O-C-N 123.423 0.452 . . . . 0.0 112.103 -165.274 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -134.42 172.94 12.2 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.747 0.819 . . . . 0.0 110.133 -171.469 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.54 151.71 44.77 Favored 'General case' 0 CA--C 1.573 1.838 0 C-N-CA 124.377 1.071 . . . . 0.0 111.468 -172.92 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 8.7 mm -99.21 152.09 4.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 C-N-CA 125.237 1.415 . . . . 0.0 109.807 174.743 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.1 m -72.33 142.76 48.82 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 122.985 0.514 . . . . 0.0 109.737 173.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 46.2 tt0 -66.47 -32.14 73.32 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.866 0.466 . . . . 0.0 110.211 175.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.434 ' HA ' ' HE3' ' A' ' 97' ' ' LYS . 35.7 m-20 -66.83 -34.95 78.94 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.737 0.815 . . . . 0.0 111.393 175.712 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -60.77 -45.15 95.46 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 123.948 0.78 . . . . 0.0 110.297 173.684 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 98.3 mt -81.64 -27.25 34.21 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 -173.354 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.434 ' HE3' ' HA ' ' A' ' 94' ' ' ASP . 16.9 ptpt -73.69 -31.39 63.41 Favored 'General case' 0 N--CA 1.483 1.207 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 177.384 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.44 -43.36 19.01 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.769 0.828 . . . . 0.0 110.838 176.299 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.2 p -150.18 94.88 3.67 Favored Pre-proline 0 CA--C 1.556 1.179 0 C-N-CA 124.477 1.111 . . . . 0.0 109.325 -178.021 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -76.05 -10.14 19.47 Favored 'Trans proline' 0 C--N 1.379 2.173 0 C-N-CA 122.574 2.183 . . . . 0.0 112.967 177.185 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' TYR . . . . . 0.42 ' HB3' HG12 ' A' ' 69' ' ' ILE . 15.3 p90 -101.8 48.91 0.87 Allowed 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.835 0.854 . . . . 0.0 110.545 -176.704 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 10.1 t -129.77 116.22 18.13 Favored Pre-proline 0 CA--C 1.55 0.968 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.383 171.838 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -76.16 -0.06 9.91 Favored 'Trans proline' 0 C--N 1.372 1.792 0 C-N-CA 122.348 2.032 . . . . 0.0 111.933 170.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.427 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 9.6 m-85 -115.56 146.36 41.81 Favored 'General case' 0 C--N 1.351 0.668 0 C-N-CA 123.974 0.909 . . . . 0.0 109.39 -176.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.418 ' SG ' ' HB2' ' A' ' 107' ' ' GLU . 23.4 p -77.11 162.87 27.12 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 172.56 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -59.87 -29.95 68.66 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 118.21 0.459 . . . . 0.0 111.881 -174.352 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 0.418 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 33.7 mt-10 -55.55 -52.3 64.18 Favored 'General case' 0 N--CA 1.481 1.101 0 O-C-N 123.986 0.804 . . . . 0.0 110.586 171.437 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.427 ' HB2' ' HB3' ' A' ' 104' ' ' PHE . 93.2 m -68.53 -39.59 81.1 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.278 178.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -63.43 -36.63 84.36 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.774 0.83 . . . . 0.0 111.115 -177.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -81.24 -22.36 38.79 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.71 0.804 . . . . 0.0 110.865 177.157 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.948 0 C-N-CA 123.838 0.855 . . . . 0.0 112.367 178.414 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 . . . . . 0 N--CA 1.477 0.88 0 CA-C-O 121.754 0.788 . . . . 0.0 110.329 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 49.2 t -77.58 -26.49 15.17 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-N 114.878 -1.056 . . . . 0.0 110.605 -177.575 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -67.06 -33.4 75.44 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.31 0.644 . . . . 0.0 110.759 178.876 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.8 m -61.94 -43.37 98.98 Favored 'General case' 0 C--O 1.243 0.732 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.378 172.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.449 ' HA ' HG22 ' A' ' 15' ' ' ILE . 22.6 m-85 -68.61 -37.97 80.19 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 114.941 -1.027 . . . . 0.0 110.585 177.414 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.488 ' HG2' HG21 ' A' ' 76' ' ' ILE . 2.5 tm-20 -56.47 -55.39 34.27 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 125.218 1.407 . . . . 0.0 110.302 -175.21 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.1 -45.03 78.46 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.79 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.457 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 12.5 tt -65.22 -31.63 54.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 CA-C-N 118.099 0.409 . . . . 0.0 110.847 -174.242 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.536 ' HB3' HG23 ' A' ' 69' ' ' ILE . 60.1 mt -64.57 -44.38 90.89 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.516 0.726 . . . . 0.0 110.449 174.577 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 53.1 mtt180 -63.44 -39.77 95.37 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 123.864 0.728 . . . . 0.0 111.357 177.347 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -65.93 -44.21 85.78 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.899 0.479 . . . . 0.0 110.473 -177.906 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.457 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -66.38 -43.58 85.5 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.893 178.276 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.65 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.0 pt20 -70.14 -29.41 66.32 Favored 'General case' 0 C--O 1.207 -1.171 0 CA-C-O 118.608 -0.711 . . . . 0.0 110.707 -177.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 87.5 mtt180 -74.93 -44.58 47.8 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.704 0.802 . . . . 0.0 112.114 -177.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -62.62 -43.37 98.99 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-O 121.371 0.605 . . . . 0.0 109.703 177.826 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.592 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 86.6 mt -70.59 -33.84 71.52 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 114.918 -1.037 . . . . 0.0 110.417 176.469 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.49 ' O ' ' HB2' ' A' ' 28' ' ' HIS . 0.2 OUTLIER -59.93 -56.62 19.42 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.285 0.634 . . . . 0.0 109.586 -177.917 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 20.4 ptt180 -64.62 -30.36 71.38 Favored 'General case' 0 N--CA 1.48 1.067 0 O-C-N 124.044 0.84 . . . . 0.0 110.895 -177.627 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -58.86 -57.75 11.68 Favored 'General case' 0 C--N 1.36 1.035 0 O-C-N 123.614 0.571 . . . . 0.0 111.359 175.193 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.618 ' HB2' ' HA ' ' A' ' 58' ' ' LEU . 2.2 pp -84.04 -25.32 29.96 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -174.508 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.49 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 5.5 m80 . . . . . 0 N--CA 1.493 1.715 0 C-N-CA 123.845 0.858 . . . . 0.0 109.571 177.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.618 ' HA ' ' HB2' ' A' ' 27' ' ' LEU . 9.2 mt . . . . . 0 CA--C 1.539 0.54 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -81.08 142.76 23.5 Favored Glycine 0 C--N 1.349 1.273 0 CA-C-O 119.292 -0.727 . . . . 0.0 112.039 177.866 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -55.41 -54.74 39.94 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 124.365 1.066 . . . . 0.0 112.014 -174.736 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.4 p -53.29 -41.24 42.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 123.701 0.8 . . . . 0.0 111.492 178.111 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.426 ' HA3' HD23 ' A' ' 27' ' ' LEU . . . -67.89 -41.64 87.68 Favored Glycine 0 C--O 1.215 -1.053 0 O-C-N 123.767 0.667 . . . . 0.0 113.049 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -66.75 -46.34 75.7 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.205 0.602 . . . . 0.0 111.01 -178.455 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -63.27 -37.3 86.69 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.837 0.855 . . . . 0.0 110.884 178.229 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -71.27 -45.03 64.1 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.141 -179.231 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.7 mp -62.27 -33.23 74.22 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.562 1.145 . . . . 0.0 110.932 176.849 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 73.3 ttt180 -67.95 -43.35 79.28 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.672 0.789 . . . . 0.0 110.339 176.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -67.62 -38.36 83.8 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.755 0.822 . . . . 0.0 111.273 179.277 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.65 HG21 ' HB3' ' A' ' 20' ' ' GLN . 96.6 mt -69.61 -41.67 80.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.858 0.863 . . . . 0.0 110.075 177.011 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -63.73 -38.56 91.55 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.673 0.789 . . . . 0.0 110.76 178.061 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.499 ' HB1' HH12 ' A' ' 75' ' ' ARG . . . -63.95 -42.91 97.17 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.867 0.867 . . . . 0.0 110.687 177.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.446 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -66.0 -51.32 59.41 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 114.913 -1.039 . . . . 0.0 111.102 179.1 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.522 HD23 HD12 ' A' ' 76' ' ' ILE . 82.1 mt -62.59 -36.72 83.61 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.427 1.091 . . . . 0.0 111.886 -179.214 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.81 -43.9 97.59 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.469 0.708 . . . . 0.0 110.244 175.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.499 HH12 ' HB1' ' A' ' 71' ' ' ALA . 80.7 mtt85 -73.51 -26.3 60.82 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 115.244 -0.889 . . . . 0.0 112.267 179.43 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.522 HD12 HD23 ' A' ' 73' ' ' LEU . 80.6 mt -69.76 -46.59 74.05 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 CA-C-N 118.473 0.579 . . . . 0.0 109.536 174.615 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.74 -36.59 83.52 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.867 178.02 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 30.2 t -81.09 -17.77 48.86 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 123.729 0.812 . . . . 0.0 111.433 177.397 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 81.6 10.3 84.55 Favored Glycine 0 C--N 1.35 1.35 0 C-N-CA 123.198 0.428 . . . . 0.0 113.893 178.556 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.8 t -106.89 21.33 17.7 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 124.415 1.086 . . . . 0.0 110.261 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -61.46 142.79 56.76 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 122.578 0.351 . . . . 0.0 110.335 173.065 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.516 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 82.5 20.72 61.49 Favored Glycine 0 C--O 1.218 -0.864 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.521 -175.234 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 26.4 m -113.11 110.43 20.43 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 117.524 0.662 . . . . 0.0 109.825 174.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' CYS . . . . . 0.446 ' HB2' HD13 ' A' ' 91' ' ' ILE . 49.2 t -73.45 93.91 2.03 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 124.459 1.104 . . . . 0.0 109.857 172.239 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 34.1 m -63.85 -22.25 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.298 1.039 . . . . 0.0 112.751 -176.676 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.534 ' HD3' ' HB3' ' A' ' 108' ' ' CYS . 56.4 tttm -69.83 -24.44 63.46 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 122.675 0.39 . . . . 0.0 111.585 -178.288 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 29.0 p -127.59 11.16 6.74 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 122.626 0.37 . . . . 0.0 110.879 173.475 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 56.63 27.11 54.38 Favored Glycine 0 C--N 1.36 1.9 0 C-N-CA 123.869 0.747 . . . . 0.0 114.932 176.427 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -135.96 -176.7 4.39 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.983 0.913 . . . . 0.0 110.228 -174.516 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.516 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 12.8 tpp180 -68.77 152.29 45.52 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 124.585 1.154 . . . . 0.0 112.664 -172.041 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.446 HD13 ' HB2' ' A' ' 84' ' ' CYS . 3.1 mm -92.16 145.36 7.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 165.302 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 61.8 m -66.99 145.25 55.6 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 122.252 0.221 . . . . 0.0 110.561 176.043 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -61.47 -39.94 92.72 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.254 0.622 . . . . 0.0 110.42 177.444 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.436 ' HA ' ' HG2' ' A' ' 97' ' ' LYS . 16.1 m-20 -65.2 -35.69 81.84 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.863 0.865 . . . . 0.0 111.303 178.266 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -63.87 -44.12 94.03 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.07 176.133 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 96.3 mt -75.45 -36.49 60.7 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.364 0.666 . . . . 0.0 112.502 -176.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.436 ' HG2' ' HA ' ' A' ' 94' ' ' ASP . 16.6 ptpt -73.25 -28.81 62.35 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 120.528 0.204 . . . . 0.0 110.713 -176.403 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -80.48 -48.66 12.49 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 123.923 0.765 . . . . 0.0 110.299 174.876 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.1 p -144.72 99.96 4.72 Favored Pre-proline 0 CA--C 1.555 1.161 0 C-N-CA 124.231 1.012 . . . . 0.0 109.299 -178.805 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -78.47 -5.57 14.97 Favored 'Trans proline' 0 C--N 1.373 1.836 0 C-N-CA 122.531 2.154 . . . . 0.0 113.021 178.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 18.9 p90 -105.34 54.37 0.7 Allowed 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.718 0.807 . . . . 0.0 110.032 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.8 t -135.14 101.57 11.24 Favored Pre-proline 0 CA--C 1.554 1.099 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.639 172.295 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -59.8 -18.79 50.91 Favored 'Trans proline' 0 C--N 1.382 2.295 0 C-N-CA 123.245 2.63 . . . . 0.0 113.096 172.886 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -104.48 126.09 51.25 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.841 0.857 . . . . 0.0 109.859 -177.744 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 16.5 p -69.39 158.88 34.25 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 171.528 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 62.9 tp60 -48.13 -39.84 21.78 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 114.09 1.144 . . . . 0.0 114.09 -169.633 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -69.37 -34.0 73.92 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-N 117.943 0.338 . . . . 0.0 111.849 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.534 ' HB3' ' HD3' ' A' ' 86' ' ' LYS . 99.5 m -72.33 -38.85 68.55 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.331 0.652 . . . . 0.0 111.396 174.19 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.58 -33.25 75.47 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.826 0.85 . . . . 0.0 111.017 176.03 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.99 -31.38 58.95 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.016 0.926 . . . . 0.0 111.047 176.815 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.848 0 C-N-CA 123.726 0.81 . . . . 0.0 112.276 -178.335 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.0 m120 . . . . . 0 N--CA 1.487 1.41 0 N-CA-C 111.817 0.303 . . . . 0.0 111.817 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 86.2 t -50.98 -41.21 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.607 1.163 . . . . 0.0 112.106 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -64.21 -37.4 87.35 Favored 'General case' 0 N--CA 1.484 1.27 0 O-C-N 123.722 0.639 . . . . 0.0 111.499 -176.783 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 17.4 m -63.0 -42.5 99.86 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.556 0.742 . . . . 0.0 110.042 176.474 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.522 ' HA ' HG22 ' A' ' 15' ' ' ILE . 28.3 m-85 -72.25 -33.79 67.77 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-N 114.611 -1.177 . . . . 0.0 110.735 179.131 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -59.73 -52.53 65.11 Favored 'General case' 0 C--O 1.246 0.875 0 C-N-CA 125.082 1.353 . . . . 0.0 110.268 -175.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.05 -48.49 68.14 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.995 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.522 HG22 ' HA ' ' A' ' 12' ' ' TYR . 13.3 tt -64.66 -29.65 48.0 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.35 0 CA-C-N 118.197 0.453 . . . . 0.0 110.688 -173.031 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.511 ' HB3' HG23 ' A' ' 69' ' ' ILE . 45.5 mt -62.34 -50.53 71.23 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.205 0.602 . . . . 0.0 110.248 172.27 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 52.3 mtm180 -64.23 -28.52 69.79 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.488 -0.778 . . . . 0.0 112.441 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -80.98 -33.34 33.85 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.302 0.641 . . . . 0.0 110.351 -177.302 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.449 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -69.46 -42.6 74.67 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.021 172.698 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.656 ' HB3' HG21 ' A' ' 69' ' ' ILE . 1.4 pt20 -71.37 -22.59 61.87 Favored 'General case' 0 C--O 1.208 -1.083 0 CA-C-O 119.349 -0.358 . . . . 0.0 110.324 179.554 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 32.6 mtt180 -62.84 -60.01 4.07 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.188 0.595 . . . . 0.0 110.52 173.218 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -60.98 -34.22 74.44 Favored 'General case' 0 N--CA 1.48 1.051 0 O-C-N 123.933 0.771 . . . . 0.0 110.833 -178.1 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 86.5 mt -69.08 -51.87 34.22 Favored 'General case' 0 C--N 1.352 0.707 0 C-N-CA 122.984 0.514 . . . . 0.0 111.336 176.277 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -56.19 -39.6 72.66 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 123.552 0.741 . . . . 0.0 111.416 -173.017 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 18.1 ptt180 -78.02 -33.36 51.16 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 122.428 0.291 . . . . 0.0 111.2 178.185 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 25.2 ttm180 -65.1 -41.42 94.95 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.517 0.727 . . . . 0.0 111.361 177.332 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.465 HD21 HD22 ' A' ' 66' ' ' LEU . 4.3 pp -94.02 -28.58 15.68 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.799 0.44 . . . . 0.0 111.193 -172.786 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 56.2 m80 . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 167.591 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.409 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 7.8 mt . . . . . 0 CA--C 1.547 0.847 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -64.65 145.01 49.11 Favored Glycine 0 N--CA 1.477 1.387 0 CA-C-O 119.592 -0.56 . . . . 0.0 113.27 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -64.07 -60.35 3.34 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.699 0.8 . . . . 0.0 111.719 -174.536 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.2 t -58.89 -32.34 47.03 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 123.881 0.872 . . . . 0.0 110.2 177.119 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.514 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -59.66 -51.77 57.02 Favored Glycine 0 C--N 1.353 1.511 0 O-C-N 124.051 0.844 . . . . 0.0 112.624 174.743 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -72.27 -36.66 69.07 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 124.098 0.959 . . . . 0.0 112.339 -175.22 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -73.28 -38.77 65.79 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.413 0.685 . . . . 0.0 110.369 -176.647 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -71.22 -37.05 72.05 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.627 174.186 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' A' ' 62' ' ' GLY . 6.2 tp -58.62 -45.95 88.13 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 124.606 1.162 . . . . 0.0 109.568 177.209 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 47.4 ttt180 -64.84 -38.84 92.31 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.481 1.112 . . . . 0.0 110.5 -178.049 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.52 -36.64 83.2 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.914 177.015 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.656 HG21 ' HB3' ' A' ' 20' ' ' GLN . 95.0 mt -69.86 -49.79 54.24 Favored 'Isoleucine or valine' 0 C--N 1.356 0.86 0 C-N-CA 123.594 0.758 . . . . 0.0 110.83 178.59 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 52.6 m-20 -65.18 -35.64 81.71 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.753 0.821 . . . . 0.0 111.151 -177.666 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.432 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -64.88 -45.5 85.73 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.312 0.645 . . . . 0.0 109.96 175.028 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.412 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -67.15 -34.91 78.58 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.993 0.917 . . . . 0.0 111.709 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.47 HD23 HD12 ' A' ' 76' ' ' ILE . 71.9 mt -72.75 -32.33 65.59 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.857 0.863 . . . . 0.0 110.821 177.099 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.57 -27.64 63.29 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.875 0.87 . . . . 0.0 110.785 174.471 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.432 ' HG2' ' O ' ' A' ' 71' ' ' ALA . 5.7 mmp_? -69.06 -42.48 76.2 Favored 'General case' 0 C--N 1.353 0.75 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 172.879 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.47 HD12 HD23 ' A' ' 73' ' ' LEU . 71.1 mt -64.68 -41.36 92.0 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 C-N-CA 123.206 0.602 . . . . 0.0 110.367 177.862 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -59.37 -38.81 81.39 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.027 0.931 . . . . 0.0 111.292 178.55 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.535 ' HB3' HG22 ' A' ' 80' ' ' THR . 35.5 t -87.05 -13.9 43.04 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 115.027 -0.988 . . . . 0.0 111.226 178.279 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 78.75 8.15 87.88 Favored Glycine 0 C--N 1.348 1.25 0 C-N-CA 123.177 0.417 . . . . 0.0 113.441 -176.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.535 HG22 ' HB3' ' A' ' 78' ' ' SER . 13.5 t -101.4 24.58 9.41 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.708 1.203 . . . . 0.0 110.065 -178.476 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -61.89 152.87 30.66 Favored 'General case' 0 C--N 1.35 0.595 0 C-N-CA 123.222 0.609 . . . . 0.0 110.351 170.398 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.53 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 70.39 21.39 77.42 Favored Glycine 0 C--N 1.344 0.984 0 CA-C-N 115.639 -0.71 . . . . 0.0 112.476 -176.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 30.9 m -118.23 113.89 22.19 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.471 0.709 . . . . 0.0 109.69 178.154 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 52.7 t -72.93 90.12 1.45 Allowed 'General case' 0 C--O 1.238 0.472 0 C-N-CA 123.438 0.695 . . . . 0.0 109.517 171.633 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 29.5 m -61.22 -23.03 28.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 124.411 1.084 . . . . 0.0 112.756 -176.89 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.401 ' HD3' ' HB3' ' A' ' 108' ' ' CYS . 54.5 tttm -64.71 -27.2 68.75 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.305 0.642 . . . . 0.0 111.588 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.442 ' SG ' ' HB2' ' A' ' 89' ' ' LYS . 30.7 p -136.14 4.12 2.94 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 112.038 0.384 . . . . 0.0 112.038 -179.252 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 63.06 30.89 78.87 Favored Glycine 0 C--N 1.349 1.264 0 O-C-N 123.128 0.267 . . . . 0.0 113.723 -178.697 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.442 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 11.5 mmmm -106.88 172.08 7.01 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.806 0.842 . . . . 0.0 110.462 -179.568 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.53 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 15.2 tpp180 -90.92 128.4 36.76 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.126 0.97 . . . . 0.0 109.651 177.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 9.2 mm -64.91 142.4 16.97 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 171.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 19.6 m -74.26 150.72 40.11 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 122.847 0.459 . . . . 0.0 109.774 177.382 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -61.96 -37.14 83.64 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 122.919 0.488 . . . . 0.0 110.287 175.293 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -62.17 -45.87 91.46 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 124.115 0.966 . . . . 0.0 110.755 176.243 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.442 ' HG3' HG21 ' A' ' 102' ' ' THR . 28.3 tpt180 -60.85 -40.62 93.57 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.405 175.813 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 82.0 mt -69.75 -38.45 76.81 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.508 0.723 . . . . 0.0 112.184 -178.597 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -79.18 -30.95 43.69 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 122.372 0.269 . . . . 0.0 110.42 -174.431 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -80.06 -39.28 30.08 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.806 0.842 . . . . 0.0 110.641 177.842 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.5 p -148.48 92.3 4.54 Favored Pre-proline 0 CA--C 1.556 1.196 0 C-N-CA 124.33 1.052 . . . . 0.0 109.49 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.06 -17.3 31.82 Favored 'Trans proline' 0 C--N 1.378 2.086 0 C-N-CA 122.404 2.069 . . . . 0.0 112.346 175.527 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 10.7 p90 -94.6 62.71 2.82 Favored 'General case' 0 C--N 1.348 0.525 0 C-N-CA 124.333 1.053 . . . . 0.0 109.092 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.442 HG21 ' HG3' ' A' ' 95' ' ' ARG . 12.4 t -137.54 117.08 10.19 Favored Pre-proline 0 CA--C 1.553 1.089 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.511 178.73 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -81.23 -7.29 12.98 Favored 'Trans proline' 0 C--N 1.368 1.568 0 C-N-CA 122.259 1.972 . . . . 0.0 111.877 169.663 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -116.97 143.97 45.11 Favored 'General case' 0 C--N 1.356 0.858 0 C-N-CA 123.465 0.706 . . . . 0.0 110.162 -175.166 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 30.6 p -80.89 164.25 22.77 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 174.697 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -51.31 -37.77 49.34 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.791 0.837 . . . . 0.0 111.705 -178.656 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -54.88 -53.59 53.48 Favored 'General case' 0 CA--C 1.55 0.957 0 O-C-N 124.378 1.049 . . . . 0.0 110.74 175.533 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.401 ' HB3' ' HD3' ' A' ' 86' ' ' LYS . 87.8 m -71.35 -34.24 70.33 Favored 'General case' 0 N--CA 1.482 1.141 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.68 -176.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -63.28 -38.85 92.75 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.718 0.807 . . . . 0.0 110.546 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -77.34 -25.94 51.57 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.802 0.841 . . . . 0.0 111.108 176.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.551 1.012 0 C-N-CA 123.898 0.879 . . . . 0.0 111.976 -176.768 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 . . . . . 0 N--CA 1.475 0.82 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 90.6 t -54.92 -41.81 60.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 CA-C-N 114.675 -1.148 . . . . 0.0 111.966 -172.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -61.07 -39.22 89.07 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.708 0.803 . . . . 0.0 111.732 -177.874 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 17.7 m -62.5 -42.2 99.34 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.379 0.672 . . . . 0.0 110.013 177.119 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.475 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 26.4 m-85 -71.6 -33.02 68.64 Favored 'General case' 0 C--O 1.213 -0.844 0 CA-C-N 114.558 -1.201 . . . . 0.0 110.788 179.066 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -67.42 -53.13 31.75 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 124.047 0.939 . . . . 0.0 110.523 -175.685 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -63.13 -43.32 98.69 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.416 -179.171 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.495 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 13.7 tt -65.24 -33.4 63.42 Favored 'Isoleucine or valine' 0 C--N 1.363 1.16 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 -177.072 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.531 ' HB3' HG23 ' A' ' 69' ' ' ILE . 61.2 mt -67.17 -36.82 82.61 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.127 0.571 . . . . 0.0 111.402 177.653 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 19.8 mtm180 -63.79 -41.49 97.92 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 123.279 0.362 . . . . 0.0 110.856 176.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -69.78 -40.25 76.15 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.028 0.531 . . . . 0.0 111.468 -179.406 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.495 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -63.99 -50.34 68.92 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.442 0.697 . . . . 0.0 110.276 178.621 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.614 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.9 pt20 -64.71 -31.56 72.83 Favored 'General case' 0 C--O 1.213 -0.864 0 CA-C-O 119.248 -0.406 . . . . 0.0 110.494 -178.706 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 29.6 mtt85 -68.68 -51.03 46.2 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.43 0.692 . . . . 0.0 112.129 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -61.37 -35.1 76.53 Favored 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 178.568 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.535 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 95.6 mt -67.0 -45.47 77.51 Favored 'General case' 0 C--O 1.215 -0.75 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.674 173.836 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -60.62 -47.24 87.1 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.883 0.873 . . . . 0.0 111.954 -173.306 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 9.0 ptp180 -66.72 -35.43 80.11 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 122.637 0.375 . . . . 0.0 110.273 176.506 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -63.5 -43.63 96.69 Favored 'General case' 0 C--N 1.362 1.11 0 C-N-CA 123.709 0.804 . . . . 0.0 112.031 178.639 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 2.7 pp -86.09 -21.23 27.76 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 122.977 0.511 . . . . 0.0 111.319 -176.862 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 57.6 m-70 . . . . . 0 N--CA 1.484 1.25 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 171.189 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.487 HD13 HD13 ' A' ' 27' ' ' LEU . 19.1 mt . . . . . 0 CA--C 1.54 0.594 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 119.82 146.1 7.66 Favored Glycine 0 N--CA 1.475 1.278 0 CA-C-O 119.253 -0.749 . . . . 0.0 111.651 177.776 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 60.3 tt0 -58.08 -50.9 71.84 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.047 0.939 . . . . 0.0 111.892 -173.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 7.1 p -54.74 -38.79 44.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 123.71 0.804 . . . . 0.0 111.402 179.787 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -71.3 -53.5 10.3 Favored Glycine 0 C--N 1.346 1.124 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.797 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -65.46 -38.11 88.86 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 124.249 1.02 . . . . 0.0 111.534 -175.065 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -69.13 -43.29 74.68 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.889 0.876 . . . . 0.0 110.252 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -70.41 -35.64 73.55 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.577 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.3 mp -63.15 -39.59 95.1 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.215 1.006 . . . . 0.0 110.792 175.518 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 52.6 ttt180 -59.89 -45.7 91.7 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.932 0.893 . . . . 0.0 110.026 175.494 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.519 ' HB1' ' O ' ' A' ' 101' ' ' TYR . . . -64.87 -44.79 88.53 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 114.713 -1.131 . . . . 0.0 111.922 -178.272 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.614 HG21 ' HB3' ' A' ' 20' ' ' GLN . 83.3 mt -70.74 -44.64 76.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 123.581 0.752 . . . . 0.0 110.81 -178.623 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -68.2 -37.48 80.95 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.365 0.666 . . . . 0.0 110.835 -175.651 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.464 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -64.93 -43.08 93.95 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.795 0.684 . . . . 0.0 110.232 176.767 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.43 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -62.09 -45.5 93.22 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 123.884 0.74 . . . . 0.0 110.996 177.649 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.541 HD23 HD12 ' A' ' 76' ' ' ILE . 86.2 mt -63.31 -34.92 78.73 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 124.263 1.025 . . . . 0.0 111.589 176.876 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.44 -35.92 81.51 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.464 0.706 . . . . 0.0 110.711 177.742 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.464 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 52.6 mtp85 -72.77 -29.09 63.01 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.987 176.511 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.541 HD12 HD23 ' A' ' 73' ' ' LEU . 84.0 mt -66.99 -44.08 88.68 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 122.574 0.35 . . . . 0.0 110.084 176.252 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.1 -35.23 80.48 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.521 0.729 . . . . 0.0 111.119 177.259 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.417 ' HB3' HG22 ' A' ' 80' ' ' THR . 32.4 t -79.64 -19.8 48.28 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 123.604 0.762 . . . . 0.0 111.358 177.535 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 80.58 12.1 83.31 Favored Glycine 0 C--N 1.351 1.365 0 C-N-CA 123.034 0.349 . . . . 0.0 113.6 -178.551 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.417 HG22 ' HB3' ' A' ' 78' ' ' SER . 10.2 t -110.28 21.54 16.59 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 124.279 1.032 . . . . 0.0 110.781 179.558 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 75.6 t80 -60.14 145.26 47.51 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.118 0.567 . . . . 0.0 111.595 171.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 75.11 38.53 39.83 Favored Glycine 0 C--N 1.348 1.247 0 O-C-N 124.016 0.823 . . . . 0.0 111.926 -176.584 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 40.5 m -127.78 117.9 22.73 Favored 'General case' 0 C--O 1.243 0.731 0 C-N-CA 124.014 0.926 . . . . 0.0 109.16 175.595 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 51.2 t -61.49 102.7 0.26 Allowed 'General case' 0 C--N 1.351 0.649 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 169.133 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 23.1 m -56.69 -38.42 57.73 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 C-N-CA 124.312 1.045 . . . . 0.0 111.562 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -68.77 -21.65 64.34 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.07 0.948 . . . . 0.0 111.361 -177.664 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 59.9 m -105.24 -29.65 10.18 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.398 0.679 . . . . 0.0 111.962 178.299 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 66.34 32.08 80.89 Favored Glycine 0 CA--C 1.536 1.35 0 N-CA-C 111.624 -0.59 . . . . 0.0 111.624 -161.009 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -130.73 -178.44 4.8 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.971 0.909 . . . . 0.0 110.999 -174.262 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 25.8 mmm180 -71.99 159.95 33.35 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.832 0.853 . . . . 0.0 113.17 -175.21 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 39.2 mm -106.93 147.0 12.62 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 CA-C-N 114.521 -1.218 . . . . 0.0 108.196 163.763 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 13.2 m -73.97 149.78 41.14 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.418 0.687 . . . . 0.0 110.252 178.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -58.8 -45.16 90.56 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.48 0.712 . . . . 0.0 110.23 175.418 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.403 ' HA ' ' HE3' ' A' ' 97' ' ' LYS . 38.0 m-20 -65.32 -31.87 73.23 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.457 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.535 ' HE ' ' HA ' ' A' ' 95' ' ' ARG . 2.1 tpm_? -70.79 -40.75 72.37 Favored 'General case' 0 C--O 1.216 -0.687 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.095 175.278 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 79.5 mt -70.63 -39.53 73.63 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.377 0.671 . . . . 0.0 111.723 -178.138 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.403 ' HE3' ' HA ' ' A' ' 94' ' ' ASP . 16.0 ptpt -71.81 -31.88 67.01 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 122.684 0.394 . . . . 0.0 110.312 -176.596 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -77.17 -58.24 3.39 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.073 0.549 . . . . 0.0 110.386 174.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.6 p -130.98 95.2 26.06 Favored Pre-proline 0 CA--C 1.562 1.427 0 C-N-CA 124.81 1.244 . . . . 0.0 109.857 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -80.14 -11.66 13.37 Favored 'Trans proline' 0 C--N 1.378 2.106 0 C-N-CA 122.71 2.273 . . . . 0.0 112.929 177.308 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' TYR . . . . . 0.519 ' O ' ' HB1' ' A' ' 68' ' ' ALA . 10.2 p90 -95.74 36.29 1.3 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.329 0.651 . . . . 0.0 111.069 179.678 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 15.0 t -106.78 120.26 48.79 Favored Pre-proline 0 CA--C 1.555 1.159 0 O-C-N 122.088 -0.382 . . . . 0.0 110.506 177.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -78.41 -9.37 16.22 Favored 'Trans proline' 0 C--N 1.376 2.013 0 C-N-CA 122.361 2.04 . . . . 0.0 112.097 168.619 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.437 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 14.9 m-85 -118.13 159.04 23.96 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.043 0.537 . . . . 0.0 110.465 -174.886 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 31.1 p -85.81 169.5 13.3 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 174.734 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.495 ' HB2' ' HD2' ' A' ' 95' ' ' ARG . 36.1 tt0 -59.32 -28.39 66.77 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 122.985 0.514 . . . . 0.0 111.439 -176.687 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -70.04 -47.17 63.14 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.319 1.048 . . . . 0.0 109.851 -178.763 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.437 ' HB2' ' HB3' ' A' ' 104' ' ' PHE . 94.0 m -68.44 -36.08 78.52 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.1 175.37 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -62.8 -36.58 83.61 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.161 0.985 . . . . 0.0 111.058 178.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.29 -33.74 70.01 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.575 174.204 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.548 0.896 0 C-N-CA 123.67 0.788 . . . . 0.0 112.84 -179.677 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.522 ' N ' HD21 ' A' ' 8' ' ' ASN . 0.7 OUTLIER . . . . . 0 N--CA 1.477 0.902 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 22.8 t -63.33 -37.68 80.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.959 -173.114 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -58.47 -41.16 84.62 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 124.192 0.933 . . . . 0.0 110.845 -178.592 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.3 m -58.54 -47.24 84.87 Favored 'General case' 0 C--N 1.351 0.654 0 O-C-N 124.097 0.873 . . . . 0.0 110.611 176.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.413 ' HA ' HG22 ' A' ' 15' ' ' ILE . 51.8 m-85 -67.87 -37.72 82.16 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 124.335 1.022 . . . . 0.0 111.361 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.456 ' O ' ' HG3' ' A' ' 17' ' ' ARG . 2.4 tm-20 -60.97 -56.49 20.45 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.29 1.036 . . . . 0.0 110.145 -176.177 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -72.13 -35.65 69.18 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.048 -175.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.445 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 11.4 tt -66.72 -33.9 66.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 CA-C-N 118.368 0.531 . . . . 0.0 110.128 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.481 ' HB3' HG23 ' A' ' 69' ' ' ILE . 64.0 mt -67.48 -38.32 84.2 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 122.964 0.506 . . . . 0.0 110.557 174.668 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.5 ' O ' ' HG2' ' A' ' 21' ' ' ARG . 15.5 mtm180 -64.79 -46.05 83.67 Favored 'General case' 0 C--N 1.353 0.732 0 O-C-N 123.314 0.384 . . . . 0.0 110.29 176.362 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.78 -46.76 88.15 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.527 0.731 . . . . 0.0 111.058 -177.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.445 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -65.74 -41.11 92.55 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.637 178.933 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.708 ' HB3' HG21 ' A' ' 69' ' ' ILE . 1.4 pt20 -67.12 -36.86 82.81 Favored 'General case' 0 C--O 1.206 -1.207 0 CA-C-O 118.937 -0.554 . . . . 0.0 110.091 -179.444 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.5 ' HG2' ' O ' ' A' ' 17' ' ' ARG . 4.2 mmp_? -61.12 -50.37 73.49 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 118.18 0.445 . . . . 0.0 110.899 -178.056 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -64.64 -33.37 75.77 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 123.511 0.507 . . . . 0.0 111.461 177.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.549 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 77.6 mt -77.35 -31.89 54.73 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 122.967 0.507 . . . . 0.0 112.105 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.439 ' HD1' ' O ' ' A' ' 20' ' ' GLN . 3.6 m-85 -65.51 -48.58 72.04 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -179.353 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 20.6 ptt180 -73.02 -26.11 61.2 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.137 178.583 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 38.4 ttm-85 -59.1 -56.86 16.73 Favored 'General case' 0 C--N 1.36 1.059 0 C-N-CA 123.234 0.614 . . . . 0.0 110.513 173.022 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 2.4 pp -82.05 -24.63 35.2 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -173.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 . . . . . 0 N--CA 1.486 1.359 0 C-N-CA 123.243 0.617 . . . . 0.0 109.892 171.985 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.505 HD22 HD13 ' A' ' 27' ' ' LEU . 79.1 mt . . . . . 0 CA--C 1.54 0.587 0 N-CA-C 111.857 0.318 . . . . 0.0 111.857 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 119.61 124.84 3.28 Favored Glycine 0 N--CA 1.472 1.096 0 N-CA-C 110.641 -0.984 . . . . 0.0 110.641 -175.069 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -58.65 -49.71 76.52 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 124.389 1.076 . . . . 0.0 112.734 -167.039 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.433 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 8.4 p -57.1 -42.74 80.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 O-C-N 124.004 0.815 . . . . 0.0 111.545 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.41 -38.63 70.07 Favored Glycine 0 C--N 1.348 1.199 0 O-C-N 123.82 0.7 . . . . 0.0 112.822 -177.342 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -63.75 -48.47 76.85 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.615 0.766 . . . . 0.0 111.488 -178.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -72.14 -23.57 61.32 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.869 179.415 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 61' ' ' VAL . 12.8 tt0 -74.97 -39.26 61.39 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 176.302 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.441 HD22 HD21 ' A' ' 27' ' ' LEU . 7.2 mp -63.67 -43.14 97.57 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.841 0.856 . . . . 0.0 110.153 173.171 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -60.5 -39.68 88.6 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 123.68 0.612 . . . . 0.0 109.881 179.316 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.12 -38.57 75.61 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.901 0.88 . . . . 0.0 111.636 178.375 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.708 HG21 ' HB3' ' A' ' 20' ' ' GLN . 78.5 mt -69.88 -57.61 7.76 Favored 'Isoleucine or valine' 0 C--N 1.363 1.153 0 C-N-CA 123.172 0.589 . . . . 0.0 110.765 -179.216 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -62.71 -28.95 70.3 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.368 1.067 . . . . 0.0 111.739 -178.461 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.445 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -69.05 -44.16 73.2 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 122.705 0.402 . . . . 0.0 110.037 172.206 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -66.11 -32.32 73.71 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.817 0.847 . . . . 0.0 111.274 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 90.4 mt -70.7 -37.31 73.57 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.963 0.905 . . . . 0.0 110.254 174.391 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.57 -26.91 65.64 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.758 0.823 . . . . 0.0 111.229 174.247 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.445 ' HG2' ' O ' ' A' ' 71' ' ' ALA . 5.7 mmp_? -70.32 -40.2 74.32 Favored 'General case' 0 C--N 1.357 0.908 0 C-N-CA 122.997 0.519 . . . . 0.0 109.799 173.486 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 81.8 mt -66.12 -43.42 92.21 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.243 0 C-N-CA 123.397 0.679 . . . . 0.0 110.292 178.466 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.29 -39.88 94.41 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.261 1.025 . . . . 0.0 110.775 178.175 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.427 ' HB3' HG22 ' A' ' 80' ' ' THR . 47.1 t -77.13 -24.73 51.62 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.677 0.791 . . . . 0.0 111.299 177.742 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 86.82 13.42 66.95 Favored Glycine 0 C--N 1.347 1.177 0 C-N-CA 123.169 0.414 . . . . 0.0 113.045 -176.43 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.427 HG22 ' HB3' ' A' ' 78' ' ' SER . 14.8 t -110.84 24.38 13.01 Favored 'General case' 0 CA--C 1.557 1.215 0 C-N-CA 124.329 1.051 . . . . 0.0 110.825 -179.087 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -70.95 142.92 51.03 Favored 'General case' 0 N--CA 1.477 0.913 0 O-C-N 121.977 -0.452 . . . . 0.0 109.95 168.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 77.29 26.97 60.56 Favored Glycine 0 C--N 1.346 1.098 0 O-C-N 123.903 0.752 . . . . 0.0 111.741 -173.135 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 49.3 m -122.77 119.71 31.42 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 124.142 0.977 . . . . 0.0 110.028 177.029 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' CYS . . . . . 0.765 ' SG ' ' SG ' ' A' ' 105' ' ' CYS . 29.5 t -63.07 94.06 0.07 Allowed 'General case' 0 C--N 1.349 0.572 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 166.581 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 34.8 m -64.98 -25.73 38.4 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 C-N-CA 124.146 0.978 . . . . 0.0 111.248 -174.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.574 ' HD3' ' HB3' ' A' ' 108' ' ' CYS . 57.7 tttm -73.94 -14.64 61.08 Favored 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 124.723 1.209 . . . . 0.0 112.159 -177.342 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.671 ' SG ' ' SG ' ' A' ' 84' ' ' CYS . 4.3 m -132.31 -21.0 2.35 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -175.926 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 69.95 52.62 18.3 Favored Glycine 0 C--N 1.347 1.173 0 O-C-N 123.228 0.33 . . . . 0.0 112.623 -169.525 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.529 ' HG2' ' HB2' ' A' ' 87' ' ' CYS . 19.5 ptpt -143.88 -167.97 2.73 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.547 0.739 . . . . 0.0 109.558 176.179 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.3 mmm180 -76.65 160.85 29.03 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.962 0.905 . . . . 0.0 113.411 -178.633 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 19.1 mm -104.57 144.18 14.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 114.342 -1.299 . . . . 0.0 107.542 159.831 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.8 p -73.93 152.97 40.0 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.589 0.756 . . . . 0.0 110.767 176.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -68.45 -36.95 79.75 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.064 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -59.35 -40.4 86.26 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.031 0.933 . . . . 0.0 111.159 175.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 29.4 tpt180 -64.06 -45.32 89.31 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.143 175.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 95.7 mt -71.02 -32.92 69.83 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.407 0.683 . . . . 0.0 112.763 -175.55 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.3 ptpt -81.75 -27.43 33.82 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.489 0.315 . . . . 0.0 110.433 -177.485 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -78.43 -43.82 26.3 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.588 0.755 . . . . 0.0 110.493 174.672 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.7 p -152.86 95.38 3.03 Favored Pre-proline 0 CA--C 1.557 1.23 0 C-N-CA 124.478 1.111 . . . . 0.0 109.2 -176.039 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -74.44 -9.82 21.8 Favored 'Trans proline' 0 C--N 1.376 2.014 0 C-N-CA 122.615 2.21 . . . . 0.0 112.487 175.496 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 11.1 p90 -102.92 67.01 0.94 Allowed 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.206 1.002 . . . . 0.0 108.965 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 10.4 t -140.92 117.91 7.74 Favored Pre-proline 0 CA--C 1.551 0.983 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.575 177.435 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.23 -24.34 23.33 Favored 'Trans proline' 0 C--N 1.373 1.838 0 C-N-CA 122.262 1.975 . . . . 0.0 111.8 173.204 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -105.54 144.82 31.77 Favored 'General case' 0 C--N 1.352 0.713 0 CA-C-O 122.305 1.05 . . . . 0.0 111.133 -176.479 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.829 ' SG ' ' HB2' ' A' ' 108' ' ' CYS . 3.5 p -64.3 164.97 10.25 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 113.628 -1.624 . . . . 0.0 110.556 167.648 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.2 tt0 -55.34 -51.82 65.5 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 123.895 0.878 . . . . 0.0 112.367 -174.53 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.56 -29.82 52.34 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -174.569 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.829 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 75.7 m -78.34 -25.61 46.48 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.358 0.263 . . . . 0.0 111.366 177.072 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.05 -35.45 69.33 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 123.705 0.628 . . . . 0.0 109.878 169.799 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.38 -29.09 63.44 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.82 0.848 . . . . 0.0 112.054 178.425 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.907 0 C-N-CA 123.689 0.796 . . . . 0.0 111.462 -174.455 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 . . . . . 0 C--O 1.246 0.906 0 CA-C-O 122.154 0.978 . . . . 0.0 110.121 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 81.7 t -65.5 -32.44 58.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 CA-C-N 114.238 -1.346 . . . . 0.0 111.135 -177.446 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -59.58 -36.34 76.05 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.191 0.996 . . . . 0.0 112.599 -176.119 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 71.9 m -69.88 -39.21 76.43 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 122.715 0.406 . . . . 0.0 111.064 176.49 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -68.99 -34.27 75.03 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.098 0.559 . . . . 0.0 110.043 175.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -63.22 -56.23 18.38 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.749 1.22 . . . . 0.0 109.259 -177.049 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.445 ' NZ ' ' HB2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -67.61 -39.84 84.71 Favored 'General case' 0 C--O 1.219 -0.545 0 CA-C-N 115.696 -0.683 . . . . 0.0 112.164 -175.057 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 13.5 tt -64.98 -31.77 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 CA-C-O 120.965 0.412 . . . . 0.0 110.242 -177.7 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.58 ' HB3' HG23 ' A' ' 69' ' ' ILE . 64.4 mt -69.63 -42.0 74.89 Favored 'General case' 0 C--N 1.349 0.556 0 C-N-CA 123.368 0.667 . . . . 0.0 110.847 174.084 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.5 ' O ' ' HG2' ' A' ' 21' ' ' ARG . 1.8 mmp_? -61.67 -46.35 90.1 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 123.388 0.675 . . . . 0.0 110.361 177.304 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -59.11 -47.34 85.61 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.583 0.753 . . . . 0.0 110.551 178.362 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -66.43 -41.27 89.44 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 114.806 -1.088 . . . . 0.0 111.544 -176.165 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.678 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.8 pt20 -71.68 -32.99 68.44 Favored 'General case' 0 C--O 1.212 -0.918 0 CA-C-O 118.525 -0.75 . . . . 0.0 110.673 -177.868 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.5 ' HG2' ' O ' ' A' ' 17' ' ' ARG . 22.9 mmt180 -67.6 -46.81 71.5 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.192 0.597 . . . . 0.0 110.826 -177.437 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -66.54 -32.88 74.5 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.871 178.193 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.532 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 89.4 mt -77.58 -32.24 53.57 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-O 118.631 -0.7 . . . . 0.0 111.842 176.364 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -58.54 -54.46 46.75 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 123.239 0.616 . . . . 0.0 109.507 178.353 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.5 ptt180 -72.83 -25.84 61.27 Favored 'General case' 0 CA--C 1.549 0.913 0 CA-C-N 114.832 -1.076 . . . . 0.0 111.522 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 52.3 ttm-85 -63.15 -52.08 63.89 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.022 0.529 . . . . 0.0 112.102 175.509 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.63 HD21 HD22 ' A' ' 66' ' ' LEU . 2.9 pp -81.44 -25.67 35.94 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 122.334 -0.229 . . . . 0.0 111.02 -178.81 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 6.1 m170 . . . . . 0 N--CA 1.486 1.366 0 C-N-CA 122.952 0.501 . . . . 0.0 110.594 169.206 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 12.5 mt . . . . . 0 C--O 1.241 0.63 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -60.79 130.74 48.38 Favored Glycine 0 C--N 1.346 1.085 0 CA-C-O 119.074 -0.848 . . . . 0.0 111.906 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -64.29 -43.2 95.48 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.244 0.617 . . . . 0.0 111.104 -174.464 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 7.8 p -58.9 -35.04 54.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 123.199 0.6 . . . . 0.0 110.958 173.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.43 -43.71 76.82 Favored Glycine 0 C--N 1.345 1.082 0 O-C-N 123.647 0.592 . . . . 0.0 112.205 175.135 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -67.5 -47.87 68.75 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 124.024 0.93 . . . . 0.0 111.554 -176.001 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -67.66 -39.3 84.55 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.445 0.698 . . . . 0.0 110.806 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -70.75 -33.17 70.53 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 123.44 0.463 . . . . 0.0 110.129 179.489 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.63 HD22 HD21 ' A' ' 27' ' ' LEU . 2.5 mp -66.18 -41.33 90.43 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.344 0.658 . . . . 0.0 110.791 173.548 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 56.4 ttt180 -58.05 -42.96 86.55 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 123.656 0.597 . . . . 0.0 109.62 175.737 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.02 -39.71 75.65 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.42 1.088 . . . . 0.0 111.919 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.678 HG21 ' HB3' ' A' ' 20' ' ' GLN . 72.9 mt -68.69 -54.08 23.15 Favored 'Isoleucine or valine' 0 C--N 1.359 1.012 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -178.488 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -67.09 -23.27 65.83 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.331 1.052 . . . . 0.0 112.605 179.557 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.467 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -65.85 -54.56 25.1 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 170.505 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.486 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -58.81 -42.38 89.03 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 124.448 1.092 . . . . 0.0 111.339 -178.361 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.508 HD23 HD12 ' A' ' 76' ' ' ILE . 95.5 mt -68.04 -38.42 82.49 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.319 1.047 . . . . 0.0 111.721 179.469 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.34 -33.0 74.93 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.173 0.589 . . . . 0.0 110.394 174.847 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.467 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 80.5 mtt-85 -74.91 -27.4 60.2 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.588 0.755 . . . . 0.0 111.36 177.869 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.508 HD12 HD23 ' A' ' 73' ' ' LEU . 76.2 mt -69.89 -44.6 78.63 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 174.129 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.37 -32.97 74.88 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 114.825 -1.08 . . . . 0.0 111.324 176.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 26.6 t -84.08 -23.2 30.91 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.439 0.696 . . . . 0.0 111.627 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 86.95 16.63 60.86 Favored Glycine 0 C--N 1.35 1.31 0 O-C-N 123.298 0.374 . . . . 0.0 113.785 -178.549 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.4 t -114.36 18.83 16.68 Favored 'General case' 0 CA--C 1.559 1.291 0 C-N-CA 124.111 0.964 . . . . 0.0 111.372 178.361 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -72.66 137.61 46.15 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 170.096 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.453 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 88.5 11.42 66.37 Favored Glycine 0 CA--C 1.528 0.857 0 O-C-N 123.987 0.804 . . . . 0.0 111.918 -171.444 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 22.7 m -118.79 118.2 30.95 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.511 0.724 . . . . 0.0 109.656 175.409 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 46.5 t -74.2 92.84 2.26 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.898 171.401 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 27.0 m -66.84 -14.45 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 124.041 0.936 . . . . 0.0 112.755 -177.648 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 47.7 tttm -76.49 -17.41 59.3 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.152 0.581 . . . . 0.0 111.844 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 31.0 p -144.26 8.6 1.4 Allowed 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 176.506 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 62.43 32.38 82.82 Favored Glycine 0 C--N 1.358 1.759 0 C-N-CA 123.247 0.451 . . . . 0.0 114.196 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 32.3 mmmt -116.05 -171.39 1.98 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.499 0.72 . . . . 0.0 110.067 -176.51 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.453 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 24.2 tpp180 -89.12 151.42 22.22 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.176 0.991 . . . . 0.0 110.364 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 9.8 mm -92.5 138.74 19.32 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 165.011 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 39.0 m -73.92 151.38 40.41 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 122.619 0.368 . . . . 0.0 110.54 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -61.36 -41.43 97.06 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.405 0.682 . . . . 0.0 109.896 174.396 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.421 ' HA ' ' HG2' ' A' ' 97' ' ' LYS . 64.0 m-20 -67.13 -33.58 75.75 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.286 178.369 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.455 ' HG3' HG21 ' A' ' 102' ' ' THR . 1.0 OUTLIER -66.43 -44.1 83.81 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.42 0.688 . . . . 0.0 109.583 174.918 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 79.4 mt -71.19 -36.01 71.78 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.764 0.826 . . . . 0.0 112.037 -177.161 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.421 ' HG2' ' HA ' ' A' ' 94' ' ' ASP . 16.0 ptpt -77.08 -28.18 54.52 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 110.256 -0.275 . . . . 0.0 110.256 -177.715 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -79.12 -40.48 30.95 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.493 0.717 . . . . 0.0 110.732 175.768 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.2 p -152.61 94.3 3.19 Favored Pre-proline 0 CA--C 1.556 1.183 0 C-N-CA 124.625 1.17 . . . . 0.0 108.79 -176.571 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.98 -13.1 19.54 Favored 'Trans proline' 0 C--N 1.375 1.935 0 C-N-CA 122.61 2.207 . . . . 0.0 113.816 -179.42 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 36.2 p90 -90.69 7.71 38.12 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -179.399 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.455 HG21 ' HG3' ' A' ' 95' ' ' ARG . 15.0 t -82.74 123.77 77.9 Favored Pre-proline 0 CA--C 1.562 1.418 0 CA-C-N 118.112 0.415 . . . . 0.0 110.735 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -84.29 0.63 9.09 Favored 'Trans proline' 0 C--N 1.368 1.605 0 C-N-CA 122.61 2.207 . . . . 0.0 111.645 167.261 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -117.39 141.63 48.09 Favored 'General case' 0 C--N 1.353 0.744 0 C-N-CA 123.929 0.892 . . . . 0.0 110.577 -173.055 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.64 ' SG ' ' HG3' ' A' ' 107' ' ' GLU . 19.8 p -80.18 173.48 12.56 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 174.922 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -60.96 -35.08 75.84 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -172.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 0.64 ' HG3' ' SG ' ' A' ' 105' ' ' CYS . 0.0 OUTLIER -72.24 -32.64 66.88 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 178.48 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 91.8 m -73.87 -38.8 64.31 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 122.452 0.301 . . . . 0.0 110.784 173.503 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.91 -32.54 74.3 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.129 0.972 . . . . 0.0 111.187 175.589 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.25 -33.45 69.83 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.74 0.816 . . . . 0.0 110.708 174.425 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.835 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.852 177.799 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 16.7 m120 . . . . . 0 N--CA 1.486 1.369 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.401 HG22 ' HD2' ' A' ' 81' ' ' PHE . 37.7 t -50.04 -42.38 19.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 C-N-CA 124.535 1.134 . . . . 0.0 111.817 178.896 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -70.62 -36.17 73.33 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 123.855 0.722 . . . . 0.0 111.925 -175.135 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 57.5 m -68.3 -35.77 78.33 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 173.487 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.419 ' HA ' HG22 ' A' ' 15' ' ' ILE . 23.1 m-85 -70.3 -36.47 74.35 Favored 'General case' 0 C--O 1.215 -0.758 0 C-N-CA 123.252 0.621 . . . . 0.0 110.403 176.404 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -63.31 -52.19 62.92 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.207 1.003 . . . . 0.0 110.303 -175.315 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.82 -42.3 95.09 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.471 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.527 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 10.6 tt -69.2 -32.76 55.1 Favored 'Isoleucine or valine' 0 C--N 1.365 1.261 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 -177.039 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.45 ' HB3' HG23 ' A' ' 69' ' ' ILE . 52.8 mt -62.78 -41.87 99.44 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 122.793 0.437 . . . . 0.0 110.451 175.438 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.523 ' O ' ' HG2' ' A' ' 21' ' ' ARG . 17.4 mtm180 -60.83 -52.62 64.28 Favored 'General case' 0 C--O 1.215 -0.737 0 O-C-N 123.626 0.579 . . . . 0.0 109.448 175.232 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -53.95 -44.86 71.06 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.43 0.692 . . . . 0.0 111.422 -176.784 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.527 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -61.44 -51.21 69.67 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 124.306 1.004 . . . . 0.0 110.867 178.956 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.666 ' HB3' HG21 ' A' ' 69' ' ' ILE . 1.8 pt20 -67.83 -29.84 69.09 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 122.983 0.177 . . . . 0.0 110.941 -176.071 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.523 ' HG2' ' O ' ' A' ' 17' ' ' ARG . 29.2 mmt180 -71.41 -54.39 10.84 Favored 'General case' 0 C--N 1.354 0.781 0 C-N-CA 123.623 0.769 . . . . 0.0 110.131 -177.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -61.63 -29.93 70.37 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.109 0.564 . . . . 0.0 110.584 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.617 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 82.5 mt -69.83 -43.32 72.22 Favored 'General case' 0 C--O 1.212 -0.869 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.94 170.861 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.43 ' O ' ' HB2' ' A' ' 28' ' ' HIS . 2.0 m-85 -56.83 -37.15 70.84 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.099 0.56 . . . . 0.0 112.062 -177.612 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 35.7 ptt180 -80.46 -29.7 37.47 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 122.169 0.187 . . . . 0.0 111.172 174.731 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 47.7 ttt85 -66.83 -37.77 85.13 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.95 0.9 . . . . 0.0 112.23 177.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.617 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 1.7 pp -97.22 -35.48 10.74 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 122.473 0.309 . . . . 0.0 111.288 -177.203 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.43 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 52.1 m-70 . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 122.242 1.02 . . . . 0.0 109.341 168.527 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 12.4 mt . . . . . 0 N--CA 1.479 0.978 0 CA-C-O 120.596 0.236 . . . . 0.0 111.046 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -95.57 132.04 10.92 Favored Glycine 0 C--N 1.346 1.102 0 N-CA-C 110.85 -0.9 . . . . 0.0 110.85 172.075 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -51.62 -51.99 51.25 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 124.49 1.116 . . . . 0.0 112.906 -175.797 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 7.4 p -66.49 -32.15 56.75 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 C-N-CA 123.851 0.86 . . . . 0.0 111.003 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -63.46 -36.93 94.03 Favored Glycine 0 C--N 1.347 1.174 0 N-CA-C 111.903 -0.479 . . . . 0.0 111.903 175.063 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -76.99 -41.12 44.15 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.312 1.045 . . . . 0.0 111.552 -178.72 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -67.74 -39.06 84.25 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.533 0.733 . . . . 0.0 110.197 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -70.64 -39.7 73.52 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.545 178.423 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.1 mp -56.2 -47.2 78.84 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.024 0.929 . . . . 0.0 110.313 172.514 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -63.37 -37.32 86.8 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.704 0.802 . . . . 0.0 110.693 -176.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.75 -37.8 70.49 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.664 0.786 . . . . 0.0 111.182 178.031 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.666 HG21 ' HB3' ' A' ' 20' ' ' GLN . 85.4 mt -67.32 -52.24 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 123.973 0.909 . . . . 0.0 110.51 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.8 -29.74 70.72 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.24 1.016 . . . . 0.0 111.213 -179.17 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.405 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -65.4 -46.14 81.19 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 122.973 0.509 . . . . 0.0 110.043 173.604 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.51 ' HB1' ' HE1' ' A' ' 81' ' ' PHE . . . -66.42 -39.98 89.28 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.391 179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.512 HD23 HD12 ' A' ' 76' ' ' ILE . 68.3 mt -69.83 -32.17 70.45 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.06 0.944 . . . . 0.0 111.188 178.508 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.54 -34.82 79.14 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.348 0.659 . . . . 0.0 110.544 174.439 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.405 ' HG2' ' O ' ' A' ' 71' ' ' ALA . 17.8 mmt180 -72.04 -37.95 69.63 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.501 176.71 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.512 HD12 HD23 ' A' ' 73' ' ' LEU . 59.6 mt -65.69 -41.62 90.88 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 CA-C-O 121.224 0.535 . . . . 0.0 109.629 175.636 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -67.66 -25.06 65.52 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.438 1.095 . . . . 0.0 111.933 178.121 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 27.5 t -100.37 2.58 42.54 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 123.739 0.816 . . . . 0.0 111.084 177.372 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 66.51 19.64 69.06 Favored Glycine 0 C--N 1.358 1.771 0 N-CA-C 114.452 0.541 . . . . 0.0 114.452 176.236 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 9.0 t -127.4 29.2 5.57 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 124.519 1.127 . . . . 0.0 110.873 -177.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.51 ' HE1' ' HB1' ' A' ' 72' ' ' ALA . 68.5 t80 -59.35 143.67 48.84 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 122.821 0.449 . . . . 0.0 110.317 167.377 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 83.48 33.63 21.93 Favored Glycine 0 C--N 1.34 0.757 0 O-C-N 123.779 0.674 . . . . 0.0 111.623 -173.65 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 59.1 m -125.66 120.36 30.51 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.385 0.674 . . . . 0.0 110.074 175.196 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' CYS . . . . . 0.423 ' HB2' ' HB3' ' A' ' 105' ' ' CYS . 48.7 t -76.66 102.18 6.06 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 123.807 0.843 . . . . 0.0 110.613 175.131 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 16.4 m -74.2 -11.45 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 124.157 0.983 . . . . 0.0 112.408 -175.117 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 52.4 tttm -81.03 -24.83 37.61 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.073 0.549 . . . . 0.0 111.381 -178.573 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.439 ' SG ' ' HB2' ' A' ' 89' ' ' LYS . 23.3 p -139.01 11.3 2.62 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 -178.487 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 62.21 26.66 67.98 Favored Glycine 0 C--N 1.353 1.512 0 N-CA-C 114.0 0.36 . . . . 0.0 114.0 -179.375 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.439 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 85.5 mttt -103.66 -168.89 1.56 Allowed 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.373 0.669 . . . . 0.0 110.853 -179.251 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 1.8 tmt_? -96.98 159.56 14.84 Favored 'General case' 0 CA--C 1.559 1.322 0 C-N-CA 124.796 1.239 . . . . 0.0 107.718 176.21 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 9.1 mm -96.25 134.21 34.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 171.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.1 m -61.73 143.64 55.89 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.476 0.711 . . . . 0.0 110.314 177.471 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -66.25 -38.08 87.0 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 118.104 0.411 . . . . 0.0 110.724 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -57.76 -40.1 78.95 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.489 0.715 . . . . 0.0 110.786 173.104 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.581 ' HG3' HG21 ' A' ' 102' ' ' THR . 25.2 tpt180 -66.32 -42.28 88.43 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.427 176.651 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 83.9 mt -68.93 -38.15 79.34 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.784 0.834 . . . . 0.0 112.628 -176.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -78.67 -32.16 47.04 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 122.399 0.28 . . . . 0.0 110.339 -176.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.65 -38.14 65.07 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.469 0.708 . . . . 0.0 110.749 176.341 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 1.7 p -155.61 99.52 2.25 Favored Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 124.773 1.229 . . . . 0.0 108.911 -178.689 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -73.02 -15.88 25.83 Favored 'Trans proline' 0 C--N 1.371 1.73 0 C-N-CA 122.445 2.096 . . . . 0.0 113.173 176.836 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 19.5 p90 -95.0 64.68 2.83 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 122.251 1.025 . . . . 0.0 109.333 179.378 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.581 HG21 ' HG3' ' A' ' 95' ' ' ARG . 13.5 t -137.94 108.53 8.32 Favored Pre-proline 0 CA--C 1.559 1.315 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.061 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.28 -8.03 18.34 Favored 'Trans proline' 0 C--N 1.371 1.757 0 C-N-CA 122.668 2.245 . . . . 0.0 112.056 169.386 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -104.68 140.22 38.37 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.06 0.944 . . . . 0.0 109.558 -178.57 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.423 ' HB3' ' HB2' ' A' ' 84' ' ' CYS . 30.3 p -78.06 169.89 17.51 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 174.738 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -52.67 -37.72 59.22 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 123.518 0.727 . . . . 0.0 111.067 -178.274 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -57.85 -54.56 45.58 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.316 174.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 93.2 m -70.25 -26.82 64.01 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.387 -174.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.61 -44.05 87.76 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.78 0.832 . . . . 0.0 110.151 174.479 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -74.48 -20.1 60.13 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.439 177.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.058 0 C-N-CA 124.107 0.963 . . . . 0.0 112.578 -177.388 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.8 m120 . . . . . 0 N--CA 1.486 1.333 0 CA-C-O 121.107 0.48 . . . . 0.0 110.166 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 72.7 t -60.55 -37.58 75.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 123.95 0.9 . . . . 0.0 111.435 -178.327 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -69.27 -31.84 70.63 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.142 0.577 . . . . 0.0 111.008 -179.833 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.3 m -66.71 -39.67 88.12 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.224 0.609 . . . . 0.0 109.974 174.203 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -70.23 -37.57 75.01 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.257 176.187 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -60.4 -53.57 56.01 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.533 1.133 . . . . 0.0 110.25 -175.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -64.75 -45.04 88.14 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.758 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.451 ' O ' ' HB2' ' A' ' 19' ' ' ARG . 10.9 tt -66.11 -32.37 57.84 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.263 0 N-CA-C 110.28 -0.267 . . . . 0.0 110.28 -174.401 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.615 ' HB3' HG23 ' A' ' 69' ' ' ILE . 69.7 mt -73.27 -38.05 66.07 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.019 0.928 . . . . 0.0 111.136 177.974 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.619 ' HE ' HD13 ' A' ' 73' ' ' LEU . 15.2 mmt85 -64.49 -41.96 96.15 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.52 0.728 . . . . 0.0 111.109 175.267 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -69.13 -35.92 76.92 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.559 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.451 ' HB2' ' O ' ' A' ' 15' ' ' ILE . 8.4 tpt180 -65.99 -48.96 69.47 Favored 'General case' 0 C--N 1.346 0.448 0 CA-C-N 114.341 -1.3 . . . . 0.0 110.799 -177.294 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.669 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.8 pt20 -70.76 -33.83 71.2 Favored 'General case' 0 C--O 1.216 -0.696 0 CA-C-O 118.947 -0.549 . . . . 0.0 110.96 -174.194 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 17' ' ' ARG . 32.5 mmt180 -76.4 -38.39 55.72 Favored 'General case' 0 C--N 1.362 1.144 0 O-C-N 123.456 0.473 . . . . 0.0 111.951 -176.084 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -67.43 -40.72 85.48 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 177.14 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.557 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 97.1 mt -69.73 -36.25 75.69 Favored 'General case' 0 C--N 1.346 0.442 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.505 175.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.449 ' HB2' ' O ' ' A' ' 20' ' ' GLN . 0.2 OUTLIER -58.61 -54.74 43.63 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.84 0.856 . . . . 0.0 110.318 -178.02 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -69.11 -28.03 66.11 Favored 'General case' 0 CA--C 1.551 1.005 0 O-C-N 124.071 0.857 . . . . 0.0 110.815 -177.866 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 50.5 ttt85 -61.96 -55.04 33.49 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.826 0.85 . . . . 0.0 111.257 174.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.703 ' HB2' ' HA ' ' A' ' 58' ' ' LEU . 3.2 pp -82.51 -9.0 59.6 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 122.791 0.436 . . . . 0.0 111.904 -178.092 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 11.6 m170 . . . . . 0 N--CA 1.482 1.127 0 C-N-CA 123.987 0.915 . . . . 0.0 109.017 171.835 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.703 ' HA ' ' HB2' ' A' ' 27' ' ' LEU . 6.8 mp . . . . . 0 CA--C 1.539 0.553 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -77.97 149.25 34.21 Favored Glycine 0 C--N 1.346 1.117 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.784 -175.256 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -57.18 -49.35 76.25 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.551 1.141 . . . . 0.0 112.521 -175.311 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 9.8 p -61.06 -38.0 78.6 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.772 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.51 -51.38 31.68 Favored Glycine 0 C--N 1.348 1.23 0 O-C-N 123.704 0.628 . . . . 0.0 112.497 -179.042 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -64.1 -47.39 80.21 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.564 0.746 . . . . 0.0 111.235 -175.519 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.25 -22.86 59.14 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.751 -177.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -74.51 -44.81 49.55 Favored 'General case' 0 C--O 1.209 -1.035 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 173.737 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.44 HD11 ' HB2' ' A' ' 23' ' ' LEU . 5.1 mp -55.74 -43.24 76.44 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 124.122 0.969 . . . . 0.0 110.72 173.456 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 55.7 ttt180 -57.77 -45.93 85.28 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.252 1.021 . . . . 0.0 110.898 176.766 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -73.74 -33.47 64.34 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.438 -179.208 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.669 HG21 ' HB3' ' A' ' 20' ' ' GLN . 66.7 mt -69.18 -51.22 45.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.127 0.971 . . . . 0.0 109.226 -178.734 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -65.88 -27.04 67.92 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.182 0.993 . . . . 0.0 111.736 177.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.73 -42.82 81.26 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 122.792 0.437 . . . . 0.0 109.969 172.592 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.445 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -69.39 -39.71 77.82 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.773 0.829 . . . . 0.0 111.374 179.033 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.619 HD13 ' HE ' ' A' ' 17' ' ' ARG . 89.7 mt -72.68 -29.01 63.05 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.153 0.981 . . . . 0.0 110.939 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.36 -35.38 75.8 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.488 0.715 . . . . 0.0 110.164 173.211 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 67.2 mtm180 -64.32 -44.73 90.65 Favored 'General case' 0 C--N 1.355 0.846 0 O-C-N 123.6 0.563 . . . . 0.0 110.483 173.055 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.564 HD12 HD23 ' A' ' 73' ' ' LEU . 63.5 mt -63.35 -45.71 97.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 -179.76 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.78 -29.33 70.55 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.289 1.036 . . . . 0.0 111.717 179.744 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.517 ' HB3' HG22 ' A' ' 80' ' ' THR . 33.5 t -88.57 -12.3 43.1 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 123.964 0.906 . . . . 0.0 111.222 177.609 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 73.58 25.67 71.76 Favored Glycine 0 C--N 1.352 1.464 0 CA-C-N 116.768 -0.197 . . . . 0.0 112.868 -177.589 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.517 HG22 ' HB3' ' A' ' 78' ' ' SER . 14.7 t -123.62 25.82 8.01 Favored 'General case' 0 CA--C 1.556 1.209 0 C-N-CA 124.668 1.187 . . . . 0.0 110.375 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -66.18 140.87 58.22 Favored 'General case' 0 N--CA 1.477 0.913 0 O-C-N 121.538 -0.726 . . . . 0.0 110.232 171.532 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.406 ' HA2' HD11 ' A' ' 96' ' ' LEU . . . 83.63 27.6 38.28 Favored Glycine 0 C--N 1.342 0.906 0 O-C-N 123.732 0.645 . . . . 0.0 111.52 -171.005 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 94.3 m -116.09 122.05 44.0 Favored 'General case' 0 C--O 1.242 0.708 0 C-N-CA 123.656 0.783 . . . . 0.0 110.182 175.193 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' CYS . . . . . 0.664 ' SG ' ' SG ' ' A' ' 105' ' ' CYS . 13.1 t -66.51 95.96 0.35 Allowed 'General case' 0 C--N 1.348 0.528 0 C-N-CA 124.31 1.044 . . . . 0.0 108.623 173.434 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 11.8 m -63.29 -29.84 48.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 C-N-CA 123.991 0.916 . . . . 0.0 112.075 -170.274 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -72.09 -21.01 61.56 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.357 1.063 . . . . 0.0 111.081 -179.552 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 84' ' ' CYS . 6.5 m -119.63 -16.74 8.79 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.752 0.821 . . . . 0.0 112.276 -169.201 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 56.95 47.68 85.06 Favored Glycine 0 C--N 1.355 1.591 0 N-CA-C 111.316 -0.714 . . . . 0.0 111.316 -166.064 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -138.84 -157.58 0.78 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.572 1.149 . . . . 0.0 110.116 -171.113 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 11.4 tpt180 -97.64 145.78 25.96 Favored 'General case' 0 CA--C 1.564 1.485 0 C-N-CA 124.083 0.953 . . . . 0.0 112.47 -176.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 5.4 mm -95.01 148.77 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 164.547 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.8 m -75.44 144.54 42.1 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 174.383 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -61.67 -37.64 84.83 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.082 0.553 . . . . 0.0 110.326 175.154 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -62.15 -38.43 88.98 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.942 0.897 . . . . 0.0 111.378 177.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.451 ' HG3' HG21 ' A' ' 102' ' ' THR . 30.3 tpt180 -64.28 -40.51 96.12 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.413 175.492 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.406 HD11 ' HA2' ' A' ' 82' ' ' GLY . 97.3 mt -78.15 -32.38 50.24 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 -175.549 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -76.11 -28.18 57.39 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -77.64 -49.56 14.29 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.538 0.735 . . . . 0.0 110.421 173.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.426 ' O ' HG22 ' A' ' 102' ' ' THR . 2.2 p -144.86 96.59 5.04 Favored Pre-proline 0 CA--C 1.558 1.251 0 C-N-CA 124.703 1.201 . . . . 0.0 109.139 -178.542 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' PRO . . . . . 0.447 ' HG2' HD21 ' A' ' 16' ' ' LEU . 55.5 Cg_endo -73.45 -23.57 17.25 Favored 'Trans proline' 0 C--N 1.378 2.123 0 C-N-CA 122.542 2.162 . . . . 0.0 113.569 -179.056 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 46.5 p90 -81.95 -2.26 50.8 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -177.006 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.451 HG21 ' HG3' ' A' ' 95' ' ' ARG . 13.8 t -68.77 122.4 84.75 Favored Pre-proline 0 CA--C 1.558 1.279 0 CA-C-N 118.373 0.533 . . . . 0.0 110.708 -179.706 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.39 -27.72 18.95 Favored 'Trans proline' 0 C--N 1.371 1.735 0 C-N-CA 122.199 1.933 . . . . 0.0 111.782 173.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.411 ' HB2' ' HB2' ' A' ' 109' ' ' ALA . 12.7 m-85 -104.44 152.18 22.63 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.628 0.771 . . . . 0.0 110.735 -174.414 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.664 ' SG ' ' SG ' ' A' ' 84' ' ' CYS . 30.7 p -72.3 157.47 37.62 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 115.138 -0.937 . . . . 0.0 108.794 170.471 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.416 ' HB2' ' HD3' ' A' ' 95' ' ' ARG . 33.5 tt0 -51.1 -39.76 56.89 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.279 1.031 . . . . 0.0 112.16 -179.3 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -66.9 -48.32 69.08 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 124.182 0.993 . . . . 0.0 109.777 -177.074 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.649 ' SG ' ' SG ' ' A' ' 105' ' ' CYS . 85.0 m -82.54 -16.01 50.21 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 114.682 -1.145 . . . . 0.0 112.566 -174.695 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.411 ' HB2' ' HB2' ' A' ' 104' ' ' PHE . . . -85.23 -26.07 26.92 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.52 0.728 . . . . 0.0 109.942 171.249 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -77.59 -23.62 49.9 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.762 0.825 . . . . 0.0 110.175 170.808 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.886 0 C-N-CA 123.797 0.839 . . . . 0.0 111.738 174.918 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 . . . . . 0 CA--C 1.537 0.479 0 N-CA-C 110.502 -0.185 . . . . 0.0 110.502 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 55.4 t -66.54 -28.31 42.95 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 C-N-CA 123.408 0.683 . . . . 0.0 110.595 175.221 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -65.92 -38.9 89.88 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.968 0.907 . . . . 0.0 112.604 -176.72 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 60.3 p -64.48 -39.76 94.41 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 174.206 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -68.93 -32.56 72.26 Favored 'General case' 0 C--O 1.215 -0.74 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.184 177.094 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.552 ' HG2' HG21 ' A' ' 76' ' ' ILE . 1.4 tm-20 -60.31 -59.3 5.63 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.355 1.062 . . . . 0.0 109.374 -177.309 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt -66.81 -39.67 87.81 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 114.623 -1.171 . . . . 0.0 112.339 -174.243 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.461 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 12.5 tt -66.99 -38.43 81.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 -177.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.581 ' HB3' HG23 ' A' ' 69' ' ' ILE . 66.0 mt -67.84 -39.03 83.9 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 122.986 0.514 . . . . 0.0 111.368 178.714 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 38.3 mmt180 -61.93 -48.16 81.66 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.123 0.569 . . . . 0.0 110.439 178.165 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -62.48 -40.9 98.18 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.261 0.624 . . . . 0.0 110.78 178.848 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.482 ' HA ' ' HG2' ' A' ' 22' ' ' GLU . 6.3 mpt_? -72.02 -38.1 69.65 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.77 0.828 . . . . 0.0 112.151 -176.423 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.524 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.5 pt20 -68.56 -33.88 74.85 Favored 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.148 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' ' 17' ' ' ARG . 24.8 mmt180 -77.8 -30.3 51.21 Favored 'General case' 0 C--N 1.349 0.571 0 CA-C-O 118.972 -0.537 . . . . 0.0 112.159 -178.866 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.482 ' HG2' ' HA ' ' A' ' 19' ' ' ARG . 5.4 pt-20 -70.2 -33.82 72.17 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 174.692 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.57 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 88.1 mt -69.25 -47.58 64.28 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.404 172.315 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.464 ' O ' ' HB2' ' A' ' 28' ' ' HIS . 1.7 m-85 -56.88 -46.61 81.74 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.909 0.883 . . . . 0.0 111.137 -175.708 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.8 ptp180 -68.02 -37.0 80.89 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 122.96 0.504 . . . . 0.0 111.031 177.514 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.555 HH11 HD23 ' A' ' 23' ' ' LEU . 41.4 ttm180 -62.8 -43.08 99.73 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.037 0.935 . . . . 0.0 112.472 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 1.5 pp -94.67 -15.74 23.7 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.545 0.338 . . . . 0.0 111.836 -177.661 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.464 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 10.1 m170 . . . . . 0 N--CA 1.49 1.528 0 C-N-CA 123.386 0.674 . . . . 0.0 109.434 168.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.478 HD22 HD13 ' A' ' 27' ' ' LEU . 6.2 mt . . . . . 0 N--CA 1.473 0.712 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -79.18 151.17 34.62 Favored Glycine 0 C--N 1.348 1.242 0 CA-C-O 119.27 -0.739 . . . . 0.0 111.423 172.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -62.43 -51.67 66.62 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.26 0.624 . . . . 0.0 111.594 -176.21 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 8.4 p -60.74 -32.53 52.16 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 123.651 0.78 . . . . 0.0 111.21 175.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.523 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -60.5 -57.0 21.22 Favored Glycine 0 C--N 1.349 1.304 0 O-C-N 123.992 0.807 . . . . 0.0 111.439 175.542 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -63.41 -38.89 92.9 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 124.636 1.174 . . . . 0.0 111.473 -178.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -62.13 -53.25 57.98 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-N 114.85 -1.068 . . . . 0.0 109.66 -175.677 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -70.75 -34.23 71.64 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-N 114.044 -1.435 . . . . 0.0 109.874 -179.516 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.523 ' HB2' ' O ' ' A' ' 62' ' ' GLY . 14.8 tp -60.71 -53.51 56.58 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.699 1.2 . . . . 0.0 111.001 -178.121 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 80.5 ttt180 -76.16 -29.75 57.84 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 113.742 -1.572 . . . . 0.0 110.171 -173.808 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.4 -47.11 80.42 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.17 0.588 . . . . 0.0 110.263 173.091 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.581 HG23 ' HB3' ' A' ' 16' ' ' LEU . 74.7 mt -62.34 -48.19 89.51 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.661 175.444 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -68.8 -33.29 73.61 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.358 0.663 . . . . 0.0 110.374 -172.301 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.9 -41.45 74.69 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.382 0.673 . . . . 0.0 109.979 175.045 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.478 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -61.63 -41.44 97.48 Favored 'General case' 0 N--CA 1.481 1.115 0 O-C-N 123.882 0.739 . . . . 0.0 110.948 177.871 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.535 HD23 HD12 ' A' ' 76' ' ' ILE . 92.5 mt -67.93 -38.1 82.46 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.695 1.198 . . . . 0.0 111.53 177.904 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.67 -31.68 72.82 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.707 175.333 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -75.12 -33.64 61.59 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.748 0.819 . . . . 0.0 111.108 176.21 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.552 HG21 ' HG2' ' A' ' 13' ' ' GLU . 73.0 mt -63.33 -43.04 98.41 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 174.135 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.87 -41.02 99.23 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.166 175.827 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.433 ' HB3' HG22 ' A' ' 80' ' ' THR . 27.2 t -83.12 -6.64 59.56 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.86 0.864 . . . . 0.0 112.095 -175.075 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.63 26.19 73.55 Favored Glycine 0 C--N 1.354 1.569 0 CA-C-O 120.962 0.201 . . . . 0.0 112.814 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.433 HG22 ' HB3' ' A' ' 78' ' ' SER . 12.4 t -130.67 27.07 4.99 Favored 'General case' 0 CA--C 1.555 1.165 0 C-N-CA 124.59 1.156 . . . . 0.0 110.417 179.326 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -66.17 146.21 54.9 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 166.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.54 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 73.16 33.57 59.13 Favored Glycine 0 C--O 1.216 -0.998 0 O-C-N 123.667 0.604 . . . . 0.0 111.74 -174.664 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 88.2 m -122.09 146.69 46.96 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.337 0.655 . . . . 0.0 109.926 176.425 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 41.2 t -115.47 102.17 9.57 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.738 1.215 . . . . 0.0 109.082 176.473 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 27.3 m -65.49 -24.96 35.74 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 C-N-CA 123.887 0.875 . . . . 0.0 113.07 -174.391 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.546 ' HD2' ' HB3' ' A' ' 108' ' ' CYS . 22.0 ttmm -74.46 -11.05 60.13 Favored 'General case' 0 CA--C 1.559 1.312 0 C-N-CA 123.097 0.559 . . . . 0.0 112.249 -177.032 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 28.0 p -138.92 1.85 2.1 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.882 -0.511 . . . . 0.0 111.722 171.353 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 59.67 31.84 72.32 Favored Glycine 0 C--N 1.356 1.66 0 O-C-N 123.526 0.517 . . . . 0.0 114.179 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 50.4 mtpt -123.88 166.39 15.74 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-N 117.105 0.452 . . . . 0.0 111.215 -174.843 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.54 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 14.1 tpp180 -69.42 140.57 54.14 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 124.5 1.12 . . . . 0.0 110.876 -179.376 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 17.0 mm -75.54 150.67 6.6 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 123.762 0.825 . . . . 0.0 109.058 171.102 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 44.3 m -70.53 145.67 50.69 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 122.873 0.469 . . . . 0.0 109.769 173.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -58.75 -40.52 84.12 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.716 0.406 . . . . 0.0 110.05 174.131 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.481 ' HA ' ' HE3' ' A' ' 97' ' ' LYS . 36.4 m-20 -64.59 -32.9 74.75 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 114.964 -1.016 . . . . 0.0 111.454 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 4.8 tpm_? -70.72 -40.35 72.85 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.468 176.358 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 98.8 mt -72.39 -35.73 68.5 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 123.598 0.561 . . . . 0.0 111.932 -177.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.481 ' HE3' ' HA ' ' A' ' 94' ' ' ASP . 15.7 ptpt -74.86 -29.72 61.11 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -77.79 -39.58 43.5 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.585 0.754 . . . . 0.0 111.099 176.554 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.5 p -157.37 96.27 2.06 Favored Pre-proline 0 CA--C 1.557 1.216 0 C-N-CA 124.53 1.132 . . . . 0.0 109.15 -177.293 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' PRO . . . . . 0.449 ' HG2' HD21 ' A' ' 16' ' ' LEU . 89.3 Cg_endo -78.53 -1.15 11.35 Favored 'Trans proline' 0 C--N 1.378 2.118 0 C-N-CA 122.796 2.331 . . . . 0.0 113.467 -179.454 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 27.1 p90 -108.6 9.81 27.19 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -178.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 12.7 t -76.78 118.47 71.96 Favored Pre-proline 0 CA--C 1.561 1.401 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 175.092 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -76.75 -6.34 16.78 Favored 'Trans proline' 0 C--N 1.376 1.977 0 C-N-CA 122.552 2.168 . . . . 0.0 112.377 178.401 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.536 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 33.0 m-85 -130.19 159.03 38.08 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.663 0.785 . . . . 0.0 109.899 -177.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 17.8 p -82.38 165.03 20.65 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 176.138 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.5 tm0? -49.19 -40.33 32.88 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.597 0.759 . . . . 0.0 111.712 -173.622 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -56.97 -54.23 49.0 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.643 0.777 . . . . 0.0 111.632 177.274 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.546 ' HB3' ' HD2' ' A' ' 86' ' ' LYS . 61.8 m -78.74 -22.14 46.96 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.56 -173.313 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -81.27 -33.05 32.95 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.789 0.835 . . . . 0.0 109.998 179.339 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -78.78 -20.26 50.26 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.674 0.79 . . . . 0.0 110.655 173.495 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.854 0 C-N-CA 123.669 0.787 . . . . 0.0 112.165 176.303 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 18.7 m120 . . . . . 0 N--CA 1.482 1.137 0 CA-C-O 121.195 0.521 . . . . 0.0 111.591 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 59.1 t -56.67 -28.2 27.12 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.318 0 CA-C-N 114.174 -1.375 . . . . 0.0 112.028 -173.582 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.8 mp0 -62.85 -43.69 98.13 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 124.75 1.22 . . . . 0.0 111.117 -174.398 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.9 m -61.28 -44.91 96.46 Favored 'General case' 0 C--O 1.241 0.64 0 CA-C-N 114.757 -1.111 . . . . 0.0 109.936 175.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.516 ' HA ' HG22 ' A' ' 15' ' ' ILE . 27.8 m-85 -72.83 -29.99 63.67 Favored 'General case' 0 C--O 1.215 -0.733 0 CA-C-N 114.84 -1.073 . . . . 0.0 111.332 -178.268 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.486 ' HG2' HD13 ' A' ' 76' ' ' ILE . 3.4 tm-20 -65.42 -53.07 48.38 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 125.001 1.32 . . . . 0.0 109.002 -174.769 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.6 ptmm? -67.32 -43.17 82.29 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 114.81 -1.087 . . . . 0.0 111.603 -179.289 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.516 HG22 ' HA ' ' A' ' 12' ' ' TYR . 13.2 tt -69.54 -29.45 41.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 CA-C-O 120.779 0.324 . . . . 0.0 110.891 -174.199 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.447 ' HB3' HG23 ' A' ' 69' ' ' ILE . 41.0 mt -64.15 -46.65 83.12 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.736 171.756 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -64.25 -38.69 91.94 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 123.424 0.453 . . . . 0.0 111.274 178.595 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -58.66 -51.47 69.78 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.101 0.56 . . . . 0.0 109.661 177.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -64.53 -40.22 95.21 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 124.267 0.979 . . . . 0.0 111.189 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.526 ' HB2' HG21 ' A' ' 69' ' ' ILE . 3.9 tt0 -66.11 -44.62 83.78 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.268 0.627 . . . . 0.0 111.368 -179.109 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.515 ' O ' ' HG2' ' A' ' 25' ' ' ARG . 17.9 mmt180 -76.22 -36.0 58.78 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 119.101 -0.476 . . . . 0.0 111.07 -172.79 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -68.57 -38.45 80.73 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 123.684 0.615 . . . . 0.0 110.144 175.433 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.424 HD22 ' HA2' ' A' ' 62' ' ' GLY . 67.2 mt -67.18 -40.61 86.59 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 122.786 0.435 . . . . 0.0 110.674 175.018 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -55.41 -58.11 9.1 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 124.267 0.98 . . . . 0.0 109.964 -175.076 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.515 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 8.1 ptm180 -64.65 -34.73 78.97 Favored 'General case' 0 CA--C 1.559 1.316 0 O-C-N 124.036 0.835 . . . . 0.0 111.71 177.123 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -63.73 -41.22 98.08 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 123.784 0.834 . . . . 0.0 112.489 -178.583 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.686 HD21 HD22 ' A' ' 66' ' ' LEU . 4.3 pp -89.8 -23.7 21.66 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 122.88 0.472 . . . . 0.0 110.061 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 67.1 m-70 . . . . . 0 N--CA 1.484 1.252 0 C-N-CA 123.328 0.651 . . . . 0.0 109.99 167.829 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 18.2 mt . . . . . 0 C--O 1.241 0.628 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -64.08 129.84 38.26 Favored Glycine 0 C--N 1.347 1.161 0 CA-C-O 119.244 -0.753 . . . . 0.0 111.483 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -63.84 -40.82 97.49 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.853 0.861 . . . . 0.0 112.235 -175.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 62.3 t -57.53 -39.23 68.07 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 C-N-CA 123.688 0.795 . . . . 0.0 109.518 173.178 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.544 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -63.87 -57.36 14.37 Favored Glycine 0 C--N 1.344 1.021 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.427 177.665 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -58.48 -42.86 88.51 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 124.966 1.306 . . . . 0.0 112.109 -175.762 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -70.19 -50.9 35.47 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.24 -173.556 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -62.78 -37.58 87.25 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.421 178.113 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.686 HD22 HD21 ' A' ' 27' ' ' LEU . 10.4 tp -58.27 -49.53 76.79 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.951 1.301 . . . . 0.0 109.963 178.368 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -66.74 -33.83 76.5 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.925 -176.078 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.34 -35.02 75.49 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.522 0.729 . . . . 0.0 110.571 175.874 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.526 HG21 ' HB2' ' A' ' 20' ' ' GLN . 97.3 mt -68.36 -54.21 23.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 123.731 0.813 . . . . 0.0 110.314 176.526 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -59.53 -32.14 70.04 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 124.918 1.287 . . . . 0.0 112.11 178.095 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.477 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -65.14 -46.61 80.24 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.303 0.641 . . . . 0.0 109.647 174.142 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.468 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -69.01 -36.18 77.5 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.702 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.576 HD23 HD12 ' A' ' 76' ' ' ILE . 73.8 mt -71.2 -34.06 70.52 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 124.165 0.986 . . . . 0.0 110.163 177.605 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.85 -36.77 85.01 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.131 173.341 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.477 ' HG2' ' O ' ' A' ' 71' ' ' ALA . 4.9 mmp_? -67.5 -35.96 80.14 Favored 'General case' 0 C--O 1.216 -0.707 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.839 175.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.576 HD12 HD23 ' A' ' 73' ' ' LEU . 64.7 mt -68.47 -43.34 83.97 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 CA-C-O 121.031 0.443 . . . . 0.0 110.385 179.004 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.7 -28.71 68.65 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.22 177.59 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.5 t -87.54 -15.9 36.17 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.786 0.834 . . . . 0.0 111.321 175.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 82.22 5.64 89.46 Favored Glycine 0 C--N 1.35 1.333 0 C-N-CA 123.187 0.422 . . . . 0.0 113.992 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.434 HG23 ' HD3' ' A' ' 75' ' ' ARG . 13.3 t -109.89 30.07 7.04 Favored 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 124.369 1.067 . . . . 0.0 110.538 -177.053 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.453 ' HE1' ' HB1' ' A' ' 72' ' ' ALA . 79.7 t80 -63.99 147.68 51.46 Favored 'General case' 0 N--CA 1.479 0.981 0 O-C-N 121.958 -0.464 . . . . 0.0 111.38 171.054 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 71.07 42.57 58.71 Favored Glycine 0 C--N 1.347 1.184 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.263 -175.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 98.0 m -129.61 122.28 28.77 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.34 1.056 . . . . 0.0 110.152 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' CYS . . . . . 0.451 ' HB2' ' HB3' ' A' ' 105' ' ' CYS . 47.3 t -76.49 100.12 5.15 Favored 'General case' 0 C--N 1.351 0.649 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 170.513 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 35.4 m -60.38 -29.06 43.51 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 O-C-N 124.318 1.011 . . . . 0.0 111.628 177.645 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.503 ' HD3' ' SG ' ' A' ' 108' ' ' CYS . 47.6 tttm -77.23 -6.28 52.48 Favored 'General case' 0 CA--C 1.56 1.351 0 C-N-CA 124.296 1.038 . . . . 0.0 111.665 -177.392 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 63.1 m -124.26 -33.96 2.99 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.981 0.913 . . . . 0.0 112.37 177.327 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 87.31 6.5 78.0 Favored Glycine 0 CA--C 1.537 1.415 0 N-CA-C 111.874 -0.49 . . . . 0.0 111.874 -160.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -96.34 -172.21 2.47 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.379 1.071 . . . . 0.0 111.233 -174.181 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 26.6 mmt85 -91.45 163.05 14.31 Favored 'General case' 0 C--O 1.244 0.791 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.467 169.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 20.1 mm -92.45 142.95 12.36 Favored 'Isoleucine or valine' 0 C--O 1.244 0.767 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 163.234 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 44.2 m -68.29 144.16 54.95 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 175.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -61.02 -36.45 79.55 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 122.625 0.37 . . . . 0.0 110.169 174.242 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -59.15 -40.88 86.92 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.304 1.042 . . . . 0.0 110.332 175.379 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.414 ' HE ' ' HA ' ' A' ' 95' ' ' ARG . 0.2 OUTLIER -71.37 -38.16 71.57 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.559 177.056 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 73.2 mt -70.44 -35.42 73.36 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.613 0.765 . . . . 0.0 112.031 -177.035 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -79.24 -27.45 42.41 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.128 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -78.97 -27.88 43.54 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.004 0.922 . . . . 0.0 111.231 174.727 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.9 p -170.86 99.3 0.42 Allowed Pre-proline 0 CA--C 1.561 1.367 0 C-N-CA 124.937 1.295 . . . . 0.0 109.212 -178.807 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -75.55 -12.59 20.45 Favored 'Trans proline' 0 C--N 1.375 1.924 0 C-N-CA 122.366 2.044 . . . . 0.0 112.675 176.662 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 12.6 p90 -101.86 57.89 0.83 Allowed 'General case' 0 C--O 1.24 0.587 0 C-N-CA 124.215 1.006 . . . . 0.0 109.599 -179.728 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 11.9 t -131.88 117.26 16.09 Favored Pre-proline 0 CA--C 1.552 1.057 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.876 174.223 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -77.4 -4.77 15.05 Favored 'Trans proline' 0 C--N 1.375 1.923 0 C-N-CA 122.65 2.233 . . . . 0.0 112.134 171.411 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.449 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 16.2 m-85 -116.02 138.5 51.16 Favored 'General case' 0 C--N 1.353 0.753 0 C-N-CA 123.932 0.893 . . . . 0.0 110.369 -173.688 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.494 ' SG ' ' HB2' ' A' ' 107' ' ' GLU . 22.0 p -72.64 168.97 17.57 Favored 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 174.157 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -52.94 -37.75 61.27 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.802 0.841 . . . . 0.0 111.861 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 0.494 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 24.8 mt-10 -54.82 -53.47 54.77 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 124.211 1.004 . . . . 0.0 110.63 176.522 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.503 ' SG ' ' HD3' ' A' ' 86' ' ' LYS . 87.8 m -71.39 -38.59 71.48 Favored 'General case' 0 C--O 1.214 -0.775 0 CA-C-N 114.563 -1.199 . . . . 0.0 111.28 -176.9 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.95 -21.35 66.82 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.35 0.66 . . . . 0.0 111.216 176.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -85.07 -31.41 23.4 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.493 0.717 . . . . 0.0 111.291 172.465 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.98 0 C-N-CA 123.517 0.727 . . . . 0.0 111.28 -176.278 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.3 t30 . . . . . 0 CA--C 1.545 0.78 0 CA-C-O 120.795 0.331 . . . . 0.0 111.555 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 39.8 t -61.32 -26.94 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.407 178.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -62.63 -40.54 97.3 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 124.305 1.042 . . . . 0.0 110.691 175.733 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.5 m -59.27 -44.18 92.46 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 121.052 0.453 . . . . 0.0 110.406 175.575 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -71.38 -32.5 68.54 Favored 'General case' 0 C--N 1.347 0.494 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.738 -179.58 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -62.49 -57.0 12.76 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.182 0.993 . . . . 0.0 109.292 -179.457 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 18.2 ptmt -66.76 -39.28 87.82 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 123.899 0.75 . . . . 0.0 112.404 -174.37 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 14.0 tt -63.37 -34.37 66.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 -179.455 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.509 ' HB3' HG23 ' A' ' 69' ' ' ILE . 80.4 mt -70.61 -33.67 71.29 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 122.927 0.491 . . . . 0.0 111.843 175.577 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.02 -46.24 85.35 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 122.964 0.505 . . . . 0.0 109.733 176.383 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -60.95 -49.94 75.43 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.775 0.83 . . . . 0.0 111.062 176.208 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.462 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 3.5 mpt_? -66.0 -37.3 85.57 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 115.168 -0.923 . . . . 0.0 111.778 -174.807 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.615 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.5 pt20 -70.72 -40.64 72.7 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 117.996 0.362 . . . . 0.0 110.389 -177.667 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 91.5 mtt-85 -79.39 -30.31 42.42 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 112.427 0.528 . . . . 0.0 112.427 -175.076 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -68.4 -31.06 70.15 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 172.609 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.492 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 97.7 mt -66.89 -51.34 56.58 Favored 'General case' 0 C--N 1.352 0.709 0 CA-C-O 119.113 -0.47 . . . . 0.0 110.232 170.326 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -49.83 -51.67 38.18 Favored 'General case' 0 N--CA 1.483 1.209 0 O-C-N 124.303 1.002 . . . . 0.0 111.923 -177.213 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.3 ptp85 -64.63 -38.66 91.77 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 123.306 0.379 . . . . 0.0 111.248 177.131 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -65.16 -33.53 76.24 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.581 0.752 . . . . 0.0 112.322 -177.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 4.1 pp -103.39 -17.03 15.43 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -175.554 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 71.4 m-70 . . . . . 0 N--CA 1.486 1.33 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 167.353 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.437 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 59.3 mt . . . . . 0 CA--C 1.558 1.267 0 N-CA-C 114.423 1.268 . . . . 0.0 114.423 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 159.41 101.69 0.17 Allowed Glycine 0 C--N 1.342 0.91 0 N-CA-C 110.149 -1.18 . . . . 0.0 110.149 -172.029 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -48.16 -53.33 17.15 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 124.552 1.141 . . . . 0.0 113.363 -168.959 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.48 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 95.1 t -57.59 -44.1 84.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 O-C-N 124.061 0.851 . . . . 0.0 110.425 -179.353 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -67.97 -33.36 79.14 Favored Glycine 0 C--N 1.347 1.179 0 O-C-N 123.98 0.8 . . . . 0.0 113.394 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -72.08 -43.67 64.47 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.521 0.728 . . . . 0.0 110.62 -179.561 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -70.22 -35.73 74.06 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.867 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.48 ' HB2' ' O ' ' A' ' 61' ' ' VAL . 2.1 tp10 -66.39 -47.56 72.92 Favored 'General case' 0 C--N 1.349 0.554 0 CA-C-N 114.866 -1.061 . . . . 0.0 109.145 179.362 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 10.5 mt -51.33 -46.82 62.77 Favored 'General case' 0 N--CA 1.482 1.134 0 O-C-N 124.544 1.153 . . . . 0.0 110.999 173.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -64.01 -36.77 85.08 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.644 -176.113 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -74.76 -33.71 62.36 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.843 0.857 . . . . 0.0 111.469 177.91 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.615 HG21 ' HB3' ' A' ' 20' ' ' GLN . 69.9 mt -69.16 -55.85 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.782 0.833 . . . . 0.0 110.078 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -66.59 -21.91 66.13 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.567 1.147 . . . . 0.0 112.221 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.82 -49.81 71.4 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 121.275 0.559 . . . . 0.0 109.818 170.091 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.467 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -66.59 -41.51 88.37 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.244 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.433 HD21 ' HB2' ' A' ' 16' ' ' LEU . 79.6 mt -63.36 -41.26 98.82 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 124.386 1.074 . . . . 0.0 111.707 178.669 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.18 -40.17 84.81 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.762 0.825 . . . . 0.0 110.347 174.526 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 79.5 mtt85 -76.07 -23.11 55.01 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 115.087 -0.96 . . . . 0.0 112.731 -179.579 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 72' ' ' ALA . 85.3 mt -71.68 -44.34 69.45 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 173.721 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.42 -33.13 75.02 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.753 176.792 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 26.0 t -83.17 -19.35 36.75 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.67 0.788 . . . . 0.0 111.279 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 84.83 10.26 79.34 Favored Glycine 0 C--N 1.349 1.281 0 C-N-CA 122.924 0.297 . . . . 0.0 113.747 179.589 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.7 t -113.84 30.81 6.98 Favored 'General case' 0 CA--C 1.558 1.269 0 C-N-CA 123.92 0.888 . . . . 0.0 110.441 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -67.37 147.29 53.12 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 122.014 -0.429 . . . . 0.0 110.41 171.476 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.484 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 74.61 44.61 25.77 Favored Glycine 0 C--N 1.345 1.068 0 O-C-N 123.551 0.532 . . . . 0.0 111.823 -177.869 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 85.5 m -123.13 123.01 39.86 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.7 0.8 . . . . 0.0 110.366 179.483 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' CYS . . . . . 0.789 ' HG ' ' HG ' ' A' ' 87' ' ' CYS . 22.4 t -70.34 89.51 0.67 Allowed 'General case' 0 C--N 1.353 0.735 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 170.954 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 15.2 m -63.56 -30.27 49.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.832 0.853 . . . . 0.0 112.3 -169.384 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 57.1 tttm -69.23 -20.2 63.95 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.203 1.001 . . . . 0.0 111.128 179.697 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.789 ' HG ' ' HG ' ' A' ' 84' ' ' CYS . 7.0 m -119.49 -16.47 8.9 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.089 0.955 . . . . 0.0 111.386 -173.603 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 65.54 21.6 68.97 Favored Glycine 0 CA--C 1.539 1.562 0 C-N-CA 122.937 0.303 . . . . 0.0 112.956 -168.148 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -104.35 -170.2 1.73 Allowed 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.582 1.153 . . . . 0.0 110.987 -174.57 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.484 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 13.2 tpp180 -91.7 154.88 18.69 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.347 1.059 . . . . 0.0 110.494 178.963 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 31.8 mm -98.05 149.34 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 168.01 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.7 m -73.97 145.43 44.65 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.833 0.853 . . . . 0.0 109.526 175.121 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.424 ' HG2' ' HZ3' ' A' ' 97' ' ' LYS . 33.5 tt0 -62.63 -30.84 71.66 Favored 'General case' 0 N--CA 1.482 1.125 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 174.596 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.528 ' HA ' ' HE2' ' A' ' 97' ' ' LYS . 17.7 m-20 -62.36 -41.75 98.85 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.297 1.039 . . . . 0.0 111.295 175.536 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.435 ' HG3' HG21 ' A' ' 102' ' ' THR . 21.9 tpt180 -68.71 -40.55 79.91 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.1 176.766 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 94.4 mt -71.44 -32.24 68.11 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.152 0.581 . . . . 0.0 112.41 -177.141 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.528 ' HE2' ' HA ' ' A' ' 94' ' ' ASP . 0.2 OUTLIER -78.13 -32.2 50.29 Favored 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -179.502 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.37 -41.33 56.63 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.003 0.921 . . . . 0.0 110.737 176.742 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.4 p -153.45 98.48 2.7 Favored Pre-proline 0 CA--C 1.556 1.175 0 C-N-CA 124.906 1.282 . . . . 0.0 108.803 -176.424 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_exo -68.73 -24.93 34.26 Favored 'Trans proline' 0 C--N 1.371 1.756 0 C-N-CA 122.584 2.189 . . . . 0.0 112.28 173.767 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 9.1 p90 -89.53 58.63 4.43 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.652 1.181 . . . . 0.0 109.988 -178.73 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.435 HG21 ' HG3' ' A' ' 95' ' ' ARG . 10.9 t -123.83 104.15 33.44 Favored Pre-proline 0 CA--C 1.559 1.294 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.684 -175.143 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -67.35 -36.63 20.09 Favored 'Trans proline' 0 C--N 1.378 2.126 0 C-N-CA 122.474 2.116 . . . . 0.0 111.839 174.191 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -99.69 174.73 6.09 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -178.738 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.695 ' SG ' ' SG ' ' A' ' 108' ' ' CYS . 24.9 p -98.38 179.09 4.83 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.343 0.657 . . . . 0.0 109.301 176.243 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -54.52 -56.88 14.34 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.739 0.816 . . . . 0.0 111.768 -179.46 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -69.32 -39.67 78.07 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.933 -176.272 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.695 ' SG ' ' SG ' ' A' ' 105' ' ' CYS . 80.6 m -78.66 -21.8 47.76 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -176.075 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -76.21 -33.12 59.26 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 171.514 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.87 -23.12 59.55 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.648 172.283 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' ALA . . . . . 0.439 ' HB3' ' HA ' ' A' ' 108' ' ' CYS . . . . . . . . 0 N--CA 1.476 0.861 0 C-N-CA 124.28 1.032 . . . . 0.0 112.048 -176.761 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 8.5 m120 . . . . . 0 N--CA 1.473 0.715 0 CA-C-O 121.235 0.541 . . . . 0.0 111.845 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 21.9 t -70.7 -29.1 36.58 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 CA-C-N 115.344 -0.844 . . . . 0.0 109.791 176.828 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -68.77 -38.07 79.8 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.668 0.787 . . . . 0.0 111.183 178.592 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 27.8 m -63.45 -37.99 89.43 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.815 174.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.413 ' HA ' HG22 ' A' ' 15' ' ' ILE . 21.0 m-85 -70.8 -34.22 71.52 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.861 175.665 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.495 ' HG2' HG21 ' A' ' 76' ' ' ILE . 4.7 mm-40 -55.42 -59.23 5.1 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 124.107 0.963 . . . . 0.0 109.963 178.749 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.2 ptmt -66.82 -45.64 77.67 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.858 -174.234 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.51 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 12.3 tt -64.3 -36.04 75.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 CA-C-N 117.861 0.301 . . . . 0.0 110.624 -174.354 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.596 ' HB3' HG23 ' A' ' 69' ' ' ILE . 63.1 mt -66.67 -38.08 86.08 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.227 0.611 . . . . 0.0 110.82 176.597 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.45 ' HA ' ' HG2' ' A' ' 20' ' ' GLN . 96.2 mtt-85 -72.18 -26.08 61.93 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 123.513 0.508 . . . . 0.0 111.57 178.881 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 53.5 m-20 -74.2 -40.06 62.73 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 122.872 0.469 . . . . 0.0 110.305 173.699 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.51 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -67.22 -40.13 86.35 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.416 177.183 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.624 ' HB3' HG21 ' A' ' 69' ' ' ILE . 1.3 pt20 -71.37 -31.07 66.89 Favored 'General case' 0 C--O 1.204 -1.303 0 CA-C-O 118.906 -0.569 . . . . 0.0 109.691 178.652 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -56.2 -54.58 43.54 Favored 'General case' 0 N--CA 1.496 1.862 0 CA-C-N 118.618 0.645 . . . . 0.0 110.548 174.913 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -67.9 -35.22 78.11 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.857 -176.714 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.543 ' HA ' ' HG2' ' A' ' 26' ' ' ARG . 97.8 mt -69.11 -50.62 46.44 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 122.792 0.437 . . . . 0.0 111.396 176.943 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -51.24 -46.0 62.18 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 124.513 1.125 . . . . 0.0 111.026 -178.672 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.1 ptm180 -75.17 -32.61 61.32 Favored 'General case' 0 CA--C 1.549 0.923 0 O-C-N 123.428 0.455 . . . . 0.0 111.779 -179.142 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.543 ' HG2' ' HA ' ' A' ' 23' ' ' LEU . 6.3 ptm180 -74.01 -27.27 60.88 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-N 118.075 0.398 . . . . 0.0 111.417 -177.614 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.0 pp -89.56 -31.99 17.35 Favored 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 110.04 -0.355 . . . . 0.0 110.04 176.535 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 55.4 m-70 . . . . . 0 N--CA 1.485 1.28 0 C-N-CA 123.146 0.578 . . . . 0.0 110.276 169.065 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 35.9 mt . . . . . 0 C--O 1.241 0.652 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -65.14 142.48 44.77 Favored Glycine 0 C--N 1.347 1.185 0 CA-C-O 119.524 -0.598 . . . . 0.0 112.309 178.267 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -58.34 -50.78 72.4 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.311 1.044 . . . . 0.0 111.286 -179.289 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 11.2 p -61.89 -33.66 59.06 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.261 177.042 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -67.23 -51.84 35.64 Favored Glycine 0 C--N 1.347 1.16 0 O-C-N 123.905 0.753 . . . . 0.0 112.443 -178.73 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -62.33 -43.87 97.82 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.06 0.944 . . . . 0.0 111.162 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -65.27 -48.04 74.6 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.973 -177.18 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -77.35 -27.38 52.69 Favored 'General case' 0 C--O 1.216 -0.669 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.83 -175.398 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.3 mp -59.72 -47.19 86.62 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-O 121.544 0.688 . . . . 0.0 109.286 169.726 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 40.0 ttt180 -60.57 -37.56 81.7 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 114.33 -1.304 . . . . 0.0 110.318 -178.669 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.33 -39.72 59.14 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.191 0.997 . . . . 0.0 111.741 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.624 HG21 ' HB3' ' A' ' 20' ' ' GLN . 67.8 mt -74.68 -57.87 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 123.713 0.805 . . . . 0.0 110.274 -177.288 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -56.2 -33.54 65.42 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.218 1.007 . . . . 0.0 111.79 177.394 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.444 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -63.53 -51.33 65.92 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 110.269 -0.271 . . . . 0.0 110.269 171.602 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.481 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -58.57 -44.78 89.87 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.942 0.897 . . . . 0.0 111.588 -177.788 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.431 HD21 ' HB2' ' A' ' 16' ' ' LEU . 95.8 mt -64.68 -38.43 90.96 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 124.745 1.218 . . . . 0.0 111.463 179.13 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.75 -33.38 74.74 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.728 176.302 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.451 ' NH1' HG11 ' A' ' 85' ' ' VAL . 79.8 mtt-85 -74.84 -25.49 59.03 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.511 0.724 . . . . 0.0 111.051 177.181 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.495 HG21 ' HG2' ' A' ' 13' ' ' GLU . 82.7 mt -70.91 -46.43 68.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 172.535 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.36 -25.79 68.19 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.861 0.864 . . . . 0.0 111.347 176.359 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.9 t -83.9 -29.57 27.07 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.941 0.896 . . . . 0.0 111.133 174.54 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 84.94 14.8 68.82 Favored Glycine 0 C--N 1.349 1.297 0 C-N-CA 123.034 0.35 . . . . 0.0 113.421 -176.866 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 15.3 t -106.13 7.57 31.74 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 123.809 0.844 . . . . 0.0 110.819 178.074 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -67.55 145.47 54.87 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 171.412 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.413 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 83.68 12.91 76.8 Favored Glycine 0 C--N 1.344 0.972 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.864 -171.19 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 43.4 m -130.39 119.18 22.34 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.217 1.007 . . . . 0.0 109.792 175.467 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 41.9 t -64.28 100.56 0.35 Allowed 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.9 0.88 . . . . 0.0 109.314 171.361 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.451 HG11 ' NH1' ' A' ' 75' ' ' ARG . 24.9 m -67.4 -23.61 30.34 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.918 0 C-N-CA 123.841 0.856 . . . . 0.0 111.782 -179.616 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 42.4 tttm -70.48 -17.56 62.97 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.598 0.759 . . . . 0.0 110.86 174.972 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 54.3 m -112.14 -29.39 7.6 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 124.295 1.038 . . . . 0.0 111.811 177.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 69.4 22.24 76.31 Favored Glycine 0 CA--C 1.539 1.58 0 CA-C-N 116.176 -0.465 . . . . 0.0 112.406 -162.374 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -126.09 174.38 8.52 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 124.674 1.19 . . . . 0.0 109.209 -174.741 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.413 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 13.3 tpp180 -67.04 158.23 31.53 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 124.708 1.203 . . . . 0.0 112.629 -173.677 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 13.1 mm -100.19 146.37 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 N-CA-C 107.786 -1.191 . . . . 0.0 107.786 164.319 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.7 m -72.36 140.97 48.75 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 173.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -63.72 -29.25 70.49 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 175.313 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -55.66 -49.68 72.25 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.658 1.183 . . . . 0.0 110.117 173.719 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.474 ' HG3' HG21 ' A' ' 102' ' ' THR . 26.2 tpt180 -62.19 -46.41 89.04 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 113.907 -1.497 . . . . 0.0 110.804 178.407 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 97.1 mt -66.22 -39.74 89.81 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.538 0.735 . . . . 0.0 112.087 -175.744 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -74.87 -32.03 61.76 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 122.353 0.261 . . . . 0.0 110.435 -176.221 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -79.3 -43.16 24.19 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.645 0.778 . . . . 0.0 111.192 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.1 p -148.2 95.32 4.12 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 124.724 1.21 . . . . 0.0 108.473 -177.782 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -79.64 -6.5 14.44 Favored 'Trans proline' 0 C--N 1.371 1.714 0 C-N-CA 122.382 2.055 . . . . 0.0 113.579 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 20.0 p90 -95.54 47.83 1.13 Allowed 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 121.732 0.777 . . . . 0.0 110.282 177.491 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.474 HG21 ' HG3' ' A' ' 95' ' ' ARG . 13.3 t -125.75 111.11 25.13 Favored Pre-proline 0 CA--C 1.559 1.302 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.241 178.765 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo -74.91 -13.48 21.63 Favored 'Trans proline' 0 C--N 1.369 1.651 0 C-N-CA 122.552 2.168 . . . . 0.0 111.834 169.275 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.415 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 10.8 m-85 -104.4 156.76 17.66 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.425 1.09 . . . . 0.0 110.331 -176.127 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 30.6 p -83.8 171.1 13.45 Favored 'General case' 0 N--CA 1.481 1.113 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 172.671 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -59.8 -35.55 74.91 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.46 0.704 . . . . 0.0 111.057 -176.017 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -58.03 -54.41 47.29 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 114.902 -1.045 . . . . 0.0 110.738 173.908 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.415 ' HB2' ' HB3' ' A' ' 104' ' ' PHE . 79.9 m -64.91 -35.8 82.3 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 123.885 0.741 . . . . 0.0 111.485 -178.544 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -63.72 -45.28 90.65 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.889 0.875 . . . . 0.0 110.258 -179.422 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.67 -20.39 61.25 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.344 177.514 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.804 0 C-N-CA 124.006 0.922 . . . . 0.0 112.227 -179.634 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 13.2 m120 . . . . . 0 N--CA 1.476 0.857 0 CA-C-O 121.12 0.486 . . . . 0.0 111.408 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 59.3 t -62.85 -36.04 73.76 Favored 'Isoleucine or valine' 0 C--N 1.351 0.671 0 C-N-CA 123.629 0.772 . . . . 0.0 110.342 -178.488 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -60.77 -38.81 86.53 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.962 0.905 . . . . 0.0 111.948 -179.86 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 28.5 m -64.92 -44.34 89.83 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.505 0.722 . . . . 0.0 110.004 175.837 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.404 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 29.4 m-85 -69.47 -32.55 71.53 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.143 179.198 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -64.55 -54.92 24.54 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.438 1.095 . . . . 0.0 109.632 -176.167 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.01 -38.76 89.26 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.733 -176.679 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 12.6 tt -69.66 -31.36 48.43 Favored 'Isoleucine or valine' 0 C--N 1.362 1.113 0 N-CA-C 110.29 -0.263 . . . . 0.0 110.29 -179.176 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.555 ' HB3' HG23 ' A' ' 69' ' ' ILE . 55.3 mt -70.96 -38.51 72.79 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.273 0.629 . . . . 0.0 111.147 176.262 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.47 ' O ' ' HG3' ' A' ' 21' ' ' ARG . 1.3 mmp_? -59.63 -46.76 88.04 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 123.694 0.621 . . . . 0.0 110.049 176.009 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.494 ' HA ' ' HD2' ' A' ' 21' ' ' ARG . 3.8 m-20 -73.25 -32.9 64.98 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -69.04 -40.14 78.76 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 122.8 0.44 . . . . 0.0 110.639 179.411 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.642 ' HB3' HG21 ' A' ' 69' ' ' ILE . 3.5 pt20 -72.46 -31.38 65.38 Favored 'General case' 0 C--O 1.2 -1.54 0 CA-C-O 118.594 -0.717 . . . . 0.0 109.715 176.918 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.494 ' HD2' ' HA ' ' A' ' 18' ' ' ASP . 65.4 mtt-85 -58.49 -48.89 79.31 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-N 118.583 0.628 . . . . 0.0 111.276 178.551 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -70.58 -32.88 70.43 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.341 -178.031 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.478 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 96.6 mt -76.93 -34.02 57.68 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 122.724 0.41 . . . . 0.0 111.943 176.328 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -67.01 -51.13 58.74 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.954 0.901 . . . . 0.0 108.815 179.583 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.6 ptp180 -62.78 -32.13 73.24 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.538 0.735 . . . . 0.0 110.302 -179.56 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -60.79 -46.64 89.72 Favored 'General case' 0 C--N 1.363 1.174 0 C-N-CA 123.656 0.782 . . . . 0.0 111.782 176.518 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.567 ' HB2' ' HA ' ' A' ' 58' ' ' LEU . 2.7 pp -96.85 -0.37 47.95 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -177.741 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 41.6 m80 . . . . . 0 N--CA 1.486 1.353 0 C-N-CA 123.895 0.878 . . . . 0.0 109.993 172.479 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.567 ' HA ' ' HB2' ' A' ' 27' ' ' LEU . 6.4 mp . . . . . 0 CA--C 1.544 0.75 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -76.99 143.47 28.8 Favored Glycine 0 N--CA 1.471 0.988 0 CA-C-O 118.502 -1.165 . . . . 0.0 110.992 179.131 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -51.81 -52.56 48.23 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 124.348 1.059 . . . . 0.0 112.546 -171.813 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.456 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 7.5 p -53.6 -39.12 36.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 O-C-N 123.841 0.713 . . . . 0.0 111.761 177.124 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.423 ' O ' HD13 ' A' ' 66' ' ' LEU . . . -68.59 -43.28 77.41 Favored Glycine 0 C--N 1.345 1.069 0 O-C-N 123.616 0.573 . . . . 0.0 112.152 177.285 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -67.26 -41.57 85.32 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.637 0.775 . . . . 0.0 110.997 -175.281 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -74.74 -28.23 60.69 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 124.094 0.871 . . . . 0.0 111.239 179.619 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.456 ' HB2' ' O ' ' A' ' 61' ' ' VAL . 0.5 OUTLIER -71.73 -44.86 63.4 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 177.63 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.423 HD13 ' O ' ' A' ' 62' ' ' GLY . 5.8 mp -57.0 -47.83 79.9 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.759 1.224 . . . . 0.0 110.171 170.416 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -61.47 -37.21 82.78 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.132 0.973 . . . . 0.0 110.834 -176.272 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.67 -40.97 65.88 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.064 0.946 . . . . 0.0 111.021 177.791 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.642 HG21 ' HB3' ' A' ' 20' ' ' GLN . 83.3 mt -66.29 -53.33 37.65 Favored 'Isoleucine or valine' 0 C--N 1.356 0.857 0 C-N-CA 123.493 0.717 . . . . 0.0 110.804 -179.205 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -65.35 -27.28 68.47 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.943 0.897 . . . . 0.0 111.925 178.283 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.3 -37.02 77.59 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 122.686 0.394 . . . . 0.0 110.326 172.436 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.518 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -69.62 -41.71 75.32 Favored 'General case' 0 C--N 1.348 0.507 0 C-N-CA 123.368 0.667 . . . . 0.0 110.644 176.919 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.532 HD23 HD12 ' A' ' 76' ' ' ILE . 86.5 mt -68.02 -32.55 73.0 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.181 0.993 . . . . 0.0 110.923 179.137 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.5 -38.93 85.07 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.819 0.848 . . . . 0.0 110.383 173.047 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.43 ' HE ' ' HA ' ' A' ' 72' ' ' ALA . 87.1 mtm180 -67.69 -30.53 70.07 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.979 174.971 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.532 HD12 HD23 ' A' ' 73' ' ' LEU . 74.2 mt -70.84 -40.85 77.1 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 175.571 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.5 -32.46 72.49 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.896 0.878 . . . . 0.0 111.526 177.239 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.491 ' HB3' HG22 ' A' ' 80' ' ' THR . 34.2 t -88.08 -22.54 24.11 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.465 0.706 . . . . 0.0 111.154 176.453 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 85.31 9.77 78.9 Favored Glycine 0 C--N 1.346 1.116 0 CA-C-N 116.594 -0.275 . . . . 0.0 113.058 -175.552 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.491 HG22 ' HB3' ' A' ' 78' ' ' SER . 15.0 t -102.97 26.4 8.21 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.221 1.008 . . . . 0.0 109.612 179.302 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 90.9 t80 -63.93 147.74 51.23 Favored 'General case' 0 C--N 1.351 0.642 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 171.91 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 69.56 46.39 55.33 Favored Glycine 0 C--N 1.341 0.854 0 N-CA-C 110.737 -0.945 . . . . 0.0 110.737 -172.279 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 98.7 m -129.63 116.95 19.61 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.703 0.801 . . . . 0.0 110.167 174.035 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 42.9 t -68.52 100.26 1.08 Allowed 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 166.26 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 33.7 m -62.19 -27.4 42.48 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 123.995 0.918 . . . . 0.0 112.456 -176.663 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.488 ' HD2' ' HB3' ' A' ' 108' ' ' CYS . 24.5 ttmm -67.21 -33.69 75.9 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.496 0.718 . . . . 0.0 110.24 174.869 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 54.7 m -86.89 -29.18 22.34 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.632 0.773 . . . . 0.0 111.149 174.638 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 66.99 22.09 72.05 Favored Glycine 0 C--N 1.342 0.894 0 CA-C-N 115.79 -0.641 . . . . 0.0 112.392 -165.2 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -138.1 173.44 11.62 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.764 0.826 . . . . 0.0 110.684 -173.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 -64.89 151.47 45.54 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.943 1.297 . . . . 0.0 114.335 -170.571 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 13.7 mm -90.94 150.78 3.64 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.952 0 C-N-CA 125.537 1.535 . . . . 0.0 109.131 173.474 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 31.6 m -75.97 151.95 37.13 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 175.453 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -59.16 -41.62 88.79 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.202 0.601 . . . . 0.0 111.142 -179.435 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -61.7 -39.46 91.55 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.042 0.937 . . . . 0.0 111.217 -178.357 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.535 ' HE ' HG21 ' A' ' 102' ' ' THR . 29.7 tpt180 -64.74 -42.98 94.79 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.741 176.293 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 92.1 mt -67.98 -41.6 82.1 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.362 0.665 . . . . 0.0 112.209 -176.845 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -71.8 -28.3 63.51 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 122.587 0.355 . . . . 0.0 110.55 -178.213 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.22 -38.3 27.21 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.54 0.736 . . . . 0.0 110.884 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.4 p -160.76 95.55 1.45 Allowed Pre-proline 0 CA--C 1.559 1.291 0 C-N-CA 124.738 1.215 . . . . 0.0 109.501 -176.108 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' PRO . . . . . 0.511 ' HG2' HD21 ' A' ' 16' ' ' LEU . 69.2 Cg_endo -77.56 -23.28 9.97 Favored 'Trans proline' 0 C--N 1.375 1.972 0 C-N-CA 122.618 2.212 . . . . 0.0 113.539 -178.838 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 32.1 p90 -80.93 -9.3 59.85 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 -174.509 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.535 HG21 ' HE ' ' A' ' 95' ' ' ARG . 12.4 t -64.87 125.99 90.14 Favored Pre-proline 0 CA--C 1.565 1.527 0 CA-C-N 117.731 0.242 . . . . 0.0 111.187 -176.199 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -75.83 -12.93 19.89 Favored 'Trans proline' 0 C--N 1.375 1.931 0 C-N-CA 122.62 2.213 . . . . 0.0 112.627 174.85 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -121.68 157.11 31.6 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.608 0.763 . . . . 0.0 110.161 -176.268 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 29.3 p -86.02 165.21 16.86 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 175.607 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -46.39 -44.16 16.89 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 124.886 1.274 . . . . 0.0 114.35 -160.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.04 -26.86 28.76 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 122.215 -0.303 . . . . 0.0 110.787 -176.286 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.488 ' HB3' ' HD2' ' A' ' 86' ' ' LYS . 95.7 m -69.86 -26.45 64.21 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.961 0.904 . . . . 0.0 110.473 174.499 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -75.45 -36.23 60.74 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.851 0.86 . . . . 0.0 110.048 172.453 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -78.13 -8.86 58.8 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.942 173.281 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.056 0 C-N-CA 123.647 0.779 . . . . 0.0 111.117 174.763 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 11.5 m120 . . . . . 0 N--CA 1.494 1.754 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.5 t -50.98 -46.83 30.64 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 C-N-CA 123.571 0.748 . . . . 0.0 112.088 175.639 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -65.56 -36.01 82.53 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.515 0.726 . . . . 0.0 111.681 -176.424 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.0 m -67.11 -37.97 84.82 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.256 176.845 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -70.23 -35.5 73.88 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.272 176.382 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.1 tm-20 -60.71 -57.63 11.87 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.984 0.913 . . . . 0.0 109.381 -176.908 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.436 ' HG3' ' N ' ' A' ' 15' ' ' ILE . 12.8 ptmt -63.82 -42.11 97.73 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.592 -176.852 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.436 ' N ' ' HG3' ' A' ' 14' ' ' LYS . 15.2 tt -68.78 -29.48 43.72 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 -175.061 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.524 ' HB3' HG23 ' A' ' 69' ' ' ILE . 70.7 mt -74.01 -35.48 64.39 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.241 0.616 . . . . 0.0 110.779 174.89 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.445 ' NH2' HD13 ' A' ' 73' ' ' LEU . 1.7 mmp_? -59.98 -49.28 78.29 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 172.356 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 49.2 m-20 -64.12 -41.64 97.15 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 124.006 0.922 . . . . 0.0 110.943 -177.798 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -66.87 -46.02 76.29 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.68 -178.626 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.592 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.8 pt20 -67.45 -29.25 68.67 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-O 118.871 -0.585 . . . . 0.0 110.099 -179.394 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.402 ' HG2' ' O ' ' A' ' 17' ' ' ARG . 33.3 mmt180 -70.22 -46.86 63.64 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.708 0.803 . . . . 0.0 111.867 -179.301 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -68.43 -32.7 72.92 Favored 'General case' 0 N--CA 1.48 1.067 0 O-C-N 123.238 0.336 . . . . 0.0 110.542 178.353 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 97.1 mt -74.54 -33.29 62.7 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.021 174.401 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -58.89 -59.66 5.09 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.012 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 38.3 ptt180 -59.01 -37.57 77.21 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 123.719 0.637 . . . . 0.0 111.28 -178.677 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 75.5 ttt180 -57.42 -56.11 26.15 Favored 'General case' 0 C--N 1.356 0.874 0 C-N-CA 124.119 0.968 . . . . 0.0 112.046 178.026 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.426 ' O ' ' HA ' ' A' ' 58' ' ' LEU . 4.5 pp -87.85 -22.55 24.39 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -172.536 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 . . . . . 0 N--CA 1.481 1.116 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 175.752 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.426 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 68.5 mt . . . . . 0 CA--C 1.546 0.793 0 N-CA-C 110.413 -0.217 . . . . 0.0 110.413 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 127.0 114.51 1.88 Allowed Glycine 0 N--CA 1.472 1.035 0 N-CA-C 110.819 -0.913 . . . . 0.0 110.819 -176.392 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -49.93 -52.62 31.93 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.273 1.429 . . . . 0.0 113.37 -170.425 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 7.4 p -53.08 -42.56 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 123.234 0.614 . . . . 0.0 112.205 -178.623 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -74.74 -32.83 56.73 Favored Glycine 0 C--N 1.344 1.011 0 CA-C-N 115.538 -0.756 . . . . 0.0 112.113 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -68.34 -45.76 71.99 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.626 0.77 . . . . 0.0 111.43 -179.034 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -64.76 -36.75 85.32 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.542 0.737 . . . . 0.0 109.662 176.795 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.31 -48.56 75.18 Favored 'General case' 0 C--N 1.354 0.789 0 O-C-N 124.122 0.889 . . . . 0.0 110.467 177.416 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.4 mp -57.38 -46.62 83.2 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.175 0.99 . . . . 0.0 110.635 177.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 77.2 ttt180 -62.24 -37.1 84.11 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.508 -178.1 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.454 ' HB1' ' O ' ' A' ' 101' ' ' TYR . . . -74.53 -39.33 62.43 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 123.995 0.918 . . . . 0.0 111.542 179.201 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.592 HG21 ' HB3' ' A' ' 20' ' ' GLN . 85.3 mt -73.06 -54.92 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 123.785 0.834 . . . . 0.0 110.39 -176.706 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -59.67 -30.18 68.58 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.05 0.94 . . . . 0.0 111.789 176.655 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.476 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -64.11 -52.68 57.99 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 123.429 0.456 . . . . 0.0 110.319 172.094 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.466 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -61.2 -40.41 93.84 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.929 0.892 . . . . 0.0 111.496 -178.138 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.519 HD23 HD12 ' A' ' 76' ' ' ILE . 66.1 mt -67.84 -37.1 81.46 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.711 1.205 . . . . 0.0 111.505 178.842 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.61 -33.04 75.01 Favored 'General case' 0 N--CA 1.478 0.951 0 O-C-N 123.615 0.572 . . . . 0.0 110.296 173.723 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.476 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 79.7 mtt-85 -79.99 -25.91 40.12 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.274 0.629 . . . . 0.0 111.466 178.288 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.519 HD12 HD23 ' A' ' 73' ' ' LEU . 98.1 mt -71.33 -49.9 44.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 175.708 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.19 -28.09 68.49 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.606 0.762 . . . . 0.0 111.106 178.429 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 30.5 t -75.56 -34.22 60.7 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.43 0.692 . . . . 0.0 110.627 172.397 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 90.78 7.94 65.88 Favored Glycine 0 CA--C 1.53 0.989 0 CA-C-N 115.759 -0.655 . . . . 0.0 113.158 -176.011 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 14.0 t -97.44 10.35 39.95 Favored 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 123.669 0.788 . . . . 0.0 110.481 178.019 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -64.93 136.55 56.95 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.082 0.553 . . . . 0.0 109.914 171.228 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.15 13.14 64.51 Favored Glycine 0 CA--C 1.527 0.803 0 O-C-N 123.619 0.575 . . . . 0.0 111.89 -169.349 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 89.4 m -125.68 119.67 28.63 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 123.741 0.816 . . . . 0.0 109.753 175.115 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' CYS . . . . . 0.469 ' HB2' HD13 ' A' ' 91' ' ' ILE . 49.6 t -77.06 91.89 3.7 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 124.072 0.949 . . . . 0.0 109.743 170.635 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 25.3 m -64.35 -20.02 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 124.016 0.927 . . . . 0.0 112.152 -178.11 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 49.8 tttm -66.41 -22.8 66.24 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.928 0.891 . . . . 0.0 111.874 -179.239 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.428 ' SG ' ' HB2' ' A' ' 89' ' ' LYS . 31.7 p -137.85 10.07 2.85 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 122.635 0.374 . . . . 0.0 111.488 177.014 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 63.85 20.21 64.07 Favored Glycine 0 C--N 1.358 1.76 0 N-CA-C 114.185 0.434 . . . . 0.0 114.185 179.822 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.428 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 31.6 mmmt -106.92 -173.77 2.37 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.094 0.958 . . . . 0.0 110.62 -176.487 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 13.1 mmm180 -83.54 163.84 20.18 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 124.454 1.102 . . . . 0.0 112.139 176.683 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.469 HD13 ' HB2' ' A' ' 84' ' ' CYS . 5.7 mm -101.21 143.43 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 N-CA-C 106.416 -1.698 . . . . 0.0 106.416 159.361 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.6 m -70.9 140.82 51.13 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 173.64 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -61.06 -35.86 78.08 Favored 'General case' 0 N--CA 1.483 1.185 0 CA-C-N 117.95 0.341 . . . . 0.0 110.124 174.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -58.29 -40.92 83.23 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.187 0.995 . . . . 0.0 110.34 175.337 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.531 ' HD2' ' HB2' ' A' ' 106' ' ' GLN . 0.2 OUTLIER -68.71 -40.19 80.08 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.699 176.947 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 94.6 mt -69.01 -34.81 75.87 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.844 0.858 . . . . 0.0 112.307 -176.868 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 15.5 ptpt -80.73 -27.08 36.99 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 122.627 0.371 . . . . 0.0 110.215 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -79.31 -29.36 42.34 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.643 0.777 . . . . 0.0 110.999 175.309 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.422 ' O ' HG22 ' A' ' 102' ' ' THR . 2.3 p -165.84 99.9 0.74 Allowed Pre-proline 0 CA--C 1.557 1.244 0 C-N-CA 124.828 1.251 . . . . 0.0 108.909 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' PRO . . . . . 0.423 ' HG2' HD21 ' A' ' 16' ' ' LEU . 79.2 Cg_endo -78.21 -12.93 15.65 Favored 'Trans proline' 0 C--N 1.373 1.845 0 C-N-CA 122.65 2.233 . . . . 0.0 113.681 179.113 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' TYR . . . . . 0.454 ' O ' ' HB1' ' A' ' 68' ' ' ALA . 24.0 p90 -94.66 22.02 6.73 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 122.601 0.361 . . . . 0.0 111.932 -179.211 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.422 HG22 ' O ' ' A' ' 99' ' ' VAL . 14.1 t -97.51 112.48 61.35 Favored Pre-proline 0 CA--C 1.56 1.358 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 172.526 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -78.39 -4.44 14.22 Favored 'Trans proline' 0 C--N 1.376 1.977 0 C-N-CA 122.635 2.224 . . . . 0.0 112.009 171.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -114.75 146.15 41.29 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.957 0.903 . . . . 0.0 109.975 -176.609 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 26.0 p -75.67 160.72 29.77 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 175.239 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.531 ' HB2' ' HD2' ' A' ' 95' ' ' ARG . 52.0 tp60 -56.61 -29.95 62.73 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 118.387 0.539 . . . . 0.0 111.779 -175.312 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -61.57 -49.75 75.41 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 124.826 1.25 . . . . 0.0 109.844 177.061 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 98.3 m -70.3 -36.29 74.25 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.346 0.658 . . . . 0.0 111.662 177.047 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -61.38 -33.97 74.55 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.782 0.833 . . . . 0.0 110.968 179.227 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -82.6 -28.91 30.52 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.819 0.847 . . . . 0.0 111.152 175.885 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.265 0 C-N-CA 124.065 0.946 . . . . 0.0 112.61 -174.418 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 52.5 t30 . . . . . 0 N--CA 1.483 1.217 0 CA-C-O 121.369 0.604 . . . . 0.0 112.026 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.8 t -71.57 -26.43 26.24 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.034 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.199 -179.118 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -58.53 -42.21 87.26 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 123.207 0.603 . . . . 0.0 112.544 -174.241 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 33.2 m -59.73 -41.86 91.83 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 121.352 0.596 . . . . 0.0 110.833 178.034 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -71.34 -38.39 71.66 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-N 114.942 -1.026 . . . . 0.0 110.487 179.024 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.469 ' O ' ' HG3' ' A' ' 17' ' ' ARG . 3.0 tm-20 -57.9 -54.95 41.09 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.507 1.123 . . . . 0.0 110.127 -177.546 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.56 -41.59 88.4 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.171 -176.771 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 14.9 tt -68.22 -29.94 46.14 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 N-CA-C 110.329 -0.249 . . . . 0.0 110.329 -177.475 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.541 ' HB3' HG23 ' A' ' 69' ' ' ILE . 77.5 mt -73.35 -33.19 64.96 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.673 0.789 . . . . 0.0 111.168 176.977 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.469 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 25.7 mtm180 -64.51 -37.51 87.78 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 175.274 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -82.52 -24.68 33.98 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.002 0.521 . . . . 0.0 110.522 -178.536 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.428 ' HD2' ' HA ' ' A' ' 19' ' ' ARG . 18.4 tpt180 -73.45 -43.45 60.29 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.505 179.347 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.576 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.7 pt20 -73.45 -29.46 62.56 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 119.005 -0.521 . . . . 0.0 110.018 176.467 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 91.8 mtt180 -55.29 -58.29 8.32 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 172.926 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.4 ' HA ' ' HE ' ' A' ' 25' ' ' ARG . 11.7 pt-20 -63.78 -38.24 90.37 Favored 'General case' 0 C--N 1.352 0.686 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.098 -175.166 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.712 HD23 HH11 ' A' ' 26' ' ' ARG . 89.4 mt -65.34 -52.24 55.12 Favored 'General case' 0 C--O 1.216 -0.688 0 O-C-N 123.877 0.735 . . . . 0.0 110.956 177.946 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -48.0 -53.49 16.03 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 124.303 1.041 . . . . 0.0 111.25 -178.575 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.4 ' HE ' ' HA ' ' A' ' 22' ' ' GLU . 29.8 ptt180 -74.88 -26.19 59.49 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -178.713 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.712 HH11 HD23 ' A' ' 23' ' ' LEU . 39.5 ttm180 -66.58 -48.94 67.97 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.832 0.853 . . . . 0.0 111.124 175.607 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.553 HD21 HD22 ' A' ' 66' ' ' LEU . 4.1 pp -80.38 -24.69 39.59 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.31 0.644 . . . . 0.0 110.679 -178.192 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 3.3 m-70 . . . . . 0 N--CA 1.483 1.179 0 C-N-CA 123.171 0.589 . . . . 0.0 111.21 171.927 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.478 HD13 HD13 ' A' ' 27' ' ' LEU . 31.8 mt . . . . . 0 N--CA 1.471 0.597 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -58.68 130.12 50.58 Favored Glycine 0 CA--C 1.534 1.242 0 CA-C-O 119.207 -0.774 . . . . 0.0 112.197 176.881 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -67.15 -42.21 84.75 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.304 0.642 . . . . 0.0 112.313 -171.596 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 7.3 p -59.9 -32.09 49.07 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 C-N-CA 122.926 0.491 . . . . 0.0 109.74 173.35 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.529 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -64.86 -56.69 15.01 Favored Glycine 0 C--O 1.214 -1.104 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.615 174.586 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.445 ' NE2' ' HB2' ' A' ' 58' ' ' LEU . 98.0 mt-30 -58.9 -43.77 91.07 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 125.173 1.389 . . . . 0.0 111.946 -176.631 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -67.28 -49.11 65.57 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.125 -175.633 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -70.02 -28.9 65.87 Favored 'General case' 0 C--O 1.217 -0.614 0 CA-C-N 114.649 -1.16 . . . . 0.0 110.24 179.34 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.553 HD22 HD21 ' A' ' 27' ' ' LEU . 11.1 tp -64.24 -44.79 90.74 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.358 1.063 . . . . 0.0 109.551 178.874 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 65.2 ttt180 -74.95 -29.48 60.94 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 114.736 -1.12 . . . . 0.0 110.507 -179.307 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.57 -41.34 88.72 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.423 0.689 . . . . 0.0 110.247 174.723 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.576 HG21 ' HB3' ' A' ' 20' ' ' GLN . 95.5 mt -70.56 -37.76 71.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.887 0.875 . . . . 0.0 109.875 175.885 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -63.24 -36.43 83.62 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.272 0.629 . . . . 0.0 110.268 176.534 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -75.88 -34.08 59.98 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.906 0.882 . . . . 0.0 111.113 177.461 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.473 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -69.92 -53.88 15.88 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.441 0.696 . . . . 0.0 110.73 -179.408 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.583 HD23 HD12 ' A' ' 76' ' ' ILE . 95.5 mt -61.78 -31.94 72.19 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.455 1.102 . . . . 0.0 111.249 176.751 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.53 -49.69 76.54 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 123.615 0.572 . . . . 0.0 110.175 172.634 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.464 ' HE ' ' HA ' ' A' ' 72' ' ' ALA . 86.8 mtm180 -63.56 -30.9 71.95 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 124.043 0.839 . . . . 0.0 111.844 178.427 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.583 HD12 HD23 ' A' ' 73' ' ' LEU . 66.4 mt -69.24 -43.42 81.37 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 177.019 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.62 -25.23 64.74 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.941 176.088 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 69.8 m -91.61 -7.55 49.78 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.413 1.085 . . . . 0.0 112.344 178.481 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 69.33 23.46 76.36 Favored Glycine 0 C--N 1.35 1.325 0 N-CA-C 113.77 0.268 . . . . 0.0 113.77 178.258 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 9.9 t -129.85 29.34 5.0 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 124.589 1.156 . . . . 0.0 110.449 -179.639 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -63.97 148.66 49.07 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 121.938 -0.476 . . . . 0.0 110.271 171.573 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.462 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 70.09 37.72 73.07 Favored Glycine 0 C--N 1.342 0.866 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.611 -175.267 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 90.8 m -129.45 124.06 33.13 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.588 0.755 . . . . 0.0 109.448 175.642 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' CYS . . . . . 0.421 ' HB3' ' HB2' ' A' ' 87' ' ' CYS . 37.5 t -67.85 108.37 2.97 Favored 'General case' 0 C--N 1.35 0.622 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 169.94 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 29.2 m -62.34 -28.47 44.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 O-C-N 124.134 0.896 . . . . 0.0 111.167 176.683 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 38.3 tttm -81.11 -8.04 59.68 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.518 1.127 . . . . 0.0 111.673 -177.758 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.529 ' HB3' ' HG2' ' A' ' 89' ' ' LYS . 60.8 m -122.07 -24.1 5.22 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.895 0.878 . . . . 0.0 111.696 176.678 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 62.77 46.58 93.35 Favored Glycine 0 CA--C 1.537 1.425 0 O-C-N 123.508 0.505 . . . . 0.0 113.178 -168.646 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.529 ' HG2' ' HB3' ' A' ' 87' ' ' CYS . 0.0 OUTLIER -159.88 171.17 19.91 Favored 'General case' 0 N--CA 1.498 1.945 0 N-CA-C 112.616 0.598 . . . . 0.0 112.616 -179.103 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.462 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 13.9 tpp180 -64.4 144.11 57.41 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 125.377 1.471 . . . . 0.0 113.192 -172.462 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 26.1 mm -91.73 149.7 4.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 125.179 1.392 . . . . 0.0 108.847 172.069 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 24.8 m -67.58 140.59 56.94 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 174.452 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -59.21 -36.54 75.59 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 122.869 0.468 . . . . 0.0 111.209 -178.684 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -63.96 -36.05 82.68 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.658 0.783 . . . . 0.0 111.267 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.523 ' HD2' ' HB2' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -65.57 -40.71 93.09 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.221 175.45 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 95.2 mt -75.07 -31.74 61.31 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -176.378 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.2 ptpt -76.03 -28.17 57.61 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 109.827 -0.435 . . . . 0.0 109.827 178.771 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -83.48 -35.24 25.05 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.671 0.788 . . . . 0.0 111.316 176.502 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.4 p -158.53 91.9 2.06 Favored Pre-proline 0 CA--C 1.557 1.237 0 C-N-CA 124.536 1.134 . . . . 0.0 109.055 -177.162 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' PRO . . . . . 0.527 ' HG2' HD21 ' A' ' 16' ' ' LEU . 58.8 Cg_endo -74.06 -28.27 11.12 Favored 'Trans proline' 0 C--N 1.377 2.069 0 C-N-CA 122.639 2.226 . . . . 0.0 113.324 -178.805 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' TYR . . . . . 0.458 ' HA ' ' HB2' ' A' ' 72' ' ' ALA . 29.6 p90 -77.96 -2.55 37.51 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -173.407 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.1 t -65.62 116.77 34.82 Favored Pre-proline 0 CA--C 1.563 1.457 0 CA-C-N 117.862 0.301 . . . . 0.0 110.72 -179.268 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -73.45 -16.51 24.38 Favored 'Trans proline' 0 C--N 1.381 2.259 0 C-N-CA 122.489 2.126 . . . . 0.0 111.474 175.619 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.489 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 12.7 m-85 -113.11 174.83 5.71 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.421 1.088 . . . . 0.0 110.279 -176.262 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 31.1 p -98.19 173.97 6.75 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.193 0.597 . . . . 0.0 109.812 175.76 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.523 ' HB2' ' HD2' ' A' ' 95' ' ' ARG . 6.6 tp60 -56.66 -38.94 72.89 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.443 0.697 . . . . 0.0 112.325 -177.042 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -64.24 -48.51 75.52 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.169 0.588 . . . . 0.0 111.404 179.186 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.489 ' HB2' ' HB3' ' A' ' 104' ' ' PHE . 97.0 m -64.85 -36.17 83.47 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.044 0.538 . . . . 0.0 110.91 176.442 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.58 -35.25 78.65 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.824 0.849 . . . . 0.0 110.68 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -77.09 -25.37 52.21 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.784 175.716 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.87 0 C-N-CA 123.743 0.817 . . . . 0.0 112.098 -179.866 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 . . . . . 0 N--CA 1.485 1.322 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.433 ' O ' ' HB2' ' A' ' 13' ' ' GLU . 88.6 t -60.93 -28.6 43.81 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 CA-C-O 119.064 -0.493 . . . . 0.0 111.826 -176.222 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -59.5 -49.17 78.81 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 174.83 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.9 m -58.43 -42.45 87.31 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.891 0.876 . . . . 0.0 110.755 179.73 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -73.16 -32.45 64.87 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.112 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 9' ' ' VAL . 3.3 tm-20 -63.99 -54.19 38.26 Favored 'General case' 0 C--O 1.243 0.728 0 C-N-CA 124.535 1.134 . . . . 0.0 109.984 -177.019 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.6 -45.0 80.61 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 114.396 -1.275 . . . . 0.0 111.406 -177.254 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 10.8 tt -64.77 -33.4 63.14 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 CA-C-N 118.08 0.4 . . . . 0.0 110.713 -175.431 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.575 ' HB3' HG23 ' A' ' 69' ' ' ILE . 37.5 mt -65.77 -45.29 83.07 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.348 0.659 . . . . 0.0 111.127 175.497 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.508 ' O ' ' HG3' ' A' ' 21' ' ' ARG . 52.1 mtm180 -62.81 -46.47 87.81 Favored 'General case' 0 C--O 1.214 -0.783 0 O-C-N 123.647 0.592 . . . . 0.0 110.986 177.691 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -56.75 -46.97 81.08 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.686 0.795 . . . . 0.0 111.268 176.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? -66.24 -33.11 75.01 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.269 179.186 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.668 ' HB3' HG21 ' A' ' 69' ' ' ILE . 1.3 pt20 -81.78 -22.14 37.35 Favored 'General case' 0 C--O 1.21 -0.985 0 CA-C-O 118.805 -0.617 . . . . 0.0 110.486 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.508 ' HG3' ' O ' ' A' ' 17' ' ' ARG . 82.4 mtt180 -65.08 -49.21 70.91 Favored 'General case' 0 N--CA 1.484 1.273 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 175.891 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -65.76 -37.54 86.62 Favored 'General case' 0 C--N 1.355 0.84 0 O-C-N 123.962 0.789 . . . . 0.0 110.676 179.328 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 71.9 mt -69.21 -41.03 77.62 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 122.803 0.441 . . . . 0.0 111.704 177.264 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -63.16 -53.47 52.81 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.369 0.668 . . . . 0.0 109.817 -177.555 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -66.45 -26.65 67.3 Favored 'General case' 0 N--CA 1.484 1.263 0 O-C-N 123.204 0.315 . . . . 0.0 111.689 178.221 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 17.4 ttm-85 -65.13 -47.97 75.25 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.536 0.734 . . . . 0.0 111.462 176.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.627 HD21 HD22 ' A' ' 66' ' ' LEU . 4.0 pp -82.19 -30.18 31.07 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-O 120.64 0.257 . . . . 0.0 110.557 -178.964 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 87.8 m-70 . . . . . 0 N--CA 1.481 1.104 0 C-N-CA 123.576 0.75 . . . . 0.0 110.958 174.875 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.437 HD13 HD13 ' A' ' 27' ' ' LEU . 11.1 mt . . . . . 0 CA--C 1.543 0.674 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -86.83 135.77 13.5 Favored Glycine 0 N--CA 1.467 0.723 0 CA-C-O 119.153 -0.804 . . . . 0.0 111.1 173.184 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -56.89 -51.7 68.05 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.441 1.097 . . . . 0.0 111.811 -176.661 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.5 t -65.34 -33.87 66.62 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 124.133 0.973 . . . . 0.0 110.117 178.212 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.614 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -64.43 -39.96 97.35 Favored Glycine 0 C--O 1.217 -0.927 0 O-C-N 123.487 0.492 . . . . 0.0 111.94 177.474 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -75.66 -38.37 58.84 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.373 1.069 . . . . 0.0 111.484 -178.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -80.75 -36.58 31.77 Favored 'General case' 0 N--CA 1.485 1.316 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.094 -173.622 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -69.85 -36.08 75.24 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 173.63 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.627 HD22 HD21 ' A' ' 27' ' ' LEU . 9.5 tp -57.86 -47.57 82.35 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.168 0.987 . . . . 0.0 109.839 171.796 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 38.8 ttt180 -56.92 -44.17 82.17 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.864 1.265 . . . . 0.0 111.193 177.827 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.8 -38.19 88.3 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.579 0.752 . . . . 0.0 110.749 179.473 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.668 HG21 ' HB3' ' A' ' 20' ' ' GLN . 74.6 mt -65.78 -50.65 69.37 Favored 'Isoleucine or valine' 0 C--N 1.351 0.647 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.332 177.217 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -68.92 -28.75 66.95 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.176 0.991 . . . . 0.0 111.617 -176.479 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.32 -44.91 77.99 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.469 0.707 . . . . 0.0 109.621 175.479 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.5 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -64.48 -45.78 85.86 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 114.76 -1.109 . . . . 0.0 110.633 177.257 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.624 HD23 HD12 ' A' ' 76' ' ' ILE . 92.6 mt -64.16 -34.28 77.7 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 124.479 1.112 . . . . 0.0 111.636 179.041 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.59 -42.17 98.47 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 123.985 0.803 . . . . 0.0 109.947 176.331 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 58.3 mtp85 -74.72 -25.43 59.12 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 114.804 -1.089 . . . . 0.0 111.881 178.721 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.624 HD12 HD23 ' A' ' 73' ' ' LEU . 47.6 mt -67.82 -44.93 85.15 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 CA-C-N 118.662 0.664 . . . . 0.0 109.957 175.077 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.34 -39.21 89.74 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 124.085 0.866 . . . . 0.0 110.379 174.697 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 27.5 t -78.3 -10.72 59.79 Favored 'General case' 0 CA--C 1.555 1.164 0 CA-C-N 115.074 -0.966 . . . . 0.0 111.725 179.355 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 77.0 10.22 86.37 Favored Glycine 0 C--N 1.351 1.411 0 N-CA-C 113.765 0.266 . . . . 0.0 113.765 178.357 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 7.5 t -117.87 27.98 8.69 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 124.724 1.21 . . . . 0.0 111.08 -179.354 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.457 ' HE1' ' HB1' ' A' ' 72' ' ' ALA . 80.1 t80 -53.43 149.14 8.01 Favored 'General case' 0 N--CA 1.485 1.313 0 O-C-N 121.901 -0.499 . . . . 0.0 111.867 170.58 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.54 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 69.52 41.83 75.05 Favored Glycine 0 C--O 1.212 -1.253 0 CA-C-N 114.619 -1.173 . . . . 0.0 111.149 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 31.5 m -124.82 108.75 12.26 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-O 121.265 0.555 . . . . 0.0 109.629 176.89 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 51.4 t -62.52 98.6 0.12 Allowed 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 114.366 -1.288 . . . . 0.0 110.659 172.085 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 27.5 m -63.65 -23.71 34.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 O-C-N 124.381 1.05 . . . . 0.0 112.374 -175.019 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.494 ' HD3' ' HB3' ' A' ' 108' ' ' CYS . 47.0 tttm -67.76 -26.32 66.06 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.453 0.701 . . . . 0.0 112.046 -177.281 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 31.9 p -133.52 4.25 3.64 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 122.614 0.366 . . . . 0.0 111.648 179.82 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 61.08 28.42 68.9 Favored Glycine 0 C--N 1.351 1.395 0 N-CA-C 114.483 0.553 . . . . 0.0 114.483 -179.616 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 46.9 mtmt -116.38 166.27 12.26 Favored 'General case' 0 N--CA 1.487 1.404 0 CA-C-N 117.238 0.519 . . . . 0.0 110.67 -177.086 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.54 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 7.2 tpp180 -67.21 146.63 54.0 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 124.517 1.127 . . . . 0.0 111.116 177.078 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 10.5 mm -85.77 144.27 9.87 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 170.155 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 5.4 m -67.94 142.19 56.09 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 109.049 -0.722 . . . . 0.0 109.049 176.431 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -62.29 -29.14 70.22 Favored 'General case' 0 N--CA 1.484 1.272 0 CA-C-N 118.294 0.497 . . . . 0.0 109.976 174.242 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -57.0 -52.96 63.17 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.534 1.134 . . . . 0.0 111.248 169.457 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.57 -35.51 80.75 Favored 'General case' 0 C--O 1.214 -0.809 0 O-C-N 124.296 0.997 . . . . 0.0 110.011 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 89.4 mt -72.69 -40.39 66.26 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.467 0.707 . . . . 0.0 111.841 -179.288 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.411 ' HZ3' ' HB3' ' A' ' 97' ' ' LYS . 0.3 OUTLIER -75.01 -28.29 60.46 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.362 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.32 -43.5 50.5 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.973 0.909 . . . . 0.0 110.842 173.541 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.3 p -151.85 99.73 2.92 Favored Pre-proline 0 CA--C 1.554 1.098 0 C-N-CA 124.6 1.16 . . . . 0.0 108.876 -177.885 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -66.65 -24.87 47.5 Favored 'Trans proline' 0 C--N 1.373 1.86 0 C-N-CA 122.789 2.326 . . . . 0.0 113.434 179.502 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 28.4 p90 -93.36 54.63 2.11 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.134 0.974 . . . . 0.0 110.677 -178.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 4.1 t -112.76 103.52 55.61 Favored Pre-proline 0 CA--C 1.554 1.1 0 C-N-CA 123.434 0.694 . . . . 0.0 110.696 -179.066 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -76.26 -9.48 19.02 Favored 'Trans proline' 0 C--N 1.376 1.976 0 C-N-CA 122.852 2.368 . . . . 0.0 112.215 168.724 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -127.08 117.17 21.9 Favored 'General case' 0 C--N 1.359 1.005 0 C-N-CA 123.501 0.721 . . . . 0.0 110.31 -174.085 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 16.7 p -64.09 159.22 20.81 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 118.145 -0.931 . . . . 0.0 109.28 175.181 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -44.91 -39.38 5.39 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 124.313 1.045 . . . . 0.0 113.493 -169.404 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -58.09 -53.79 54.22 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.155 0.982 . . . . 0.0 111.217 176.565 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.494 ' HB3' ' HD3' ' A' ' 86' ' ' LYS . 85.0 m -73.4 -31.88 64.13 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 114.759 -1.109 . . . . 0.0 111.754 -176.376 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.9 -38.91 92.55 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.127 0.971 . . . . 0.0 110.507 176.482 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.75 -30.19 62.65 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.489 0.716 . . . . 0.0 110.876 174.338 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.928 0 C-N-CA 123.822 0.849 . . . . 0.0 112.453 -179.509 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 . . . . . 0 C--O 1.241 0.651 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 60.5 t -67.72 -33.94 64.8 Favored 'Isoleucine or valine' 0 C--N 1.347 0.482 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.225 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -65.34 -30.22 71.04 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 123.836 0.71 . . . . 0.0 111.697 179.003 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 47.5 m -65.88 -44.23 85.94 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 122.708 0.403 . . . . 0.0 110.061 173.632 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -67.95 -35.19 77.98 Favored 'General case' 0 C--O 1.217 -0.634 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.51 176.219 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.9 tm-20 -63.59 -55.31 24.77 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.299 1.039 . . . . 0.0 109.41 -176.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.422 ' HB2' ' HE3' ' A' ' 14' ' ' LYS . 15.4 ptmt -71.03 -35.46 71.99 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.252 -173.562 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.501 ' O ' ' HB2' ' A' ' 19' ' ' ARG . 12.3 tt -65.87 -33.95 67.02 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.551 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.55 ' HB3' HG23 ' A' ' 69' ' ' ILE . 69.6 mt -75.58 -34.05 60.64 Favored 'General case' 0 C--N 1.355 0.824 0 C-N-CA 123.952 0.901 . . . . 0.0 111.587 176.848 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.449 ' NH2' HD13 ' A' ' 73' ' ' LEU . 3.6 mmp_? -58.15 -49.91 75.35 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.097 0.559 . . . . 0.0 109.803 174.665 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -74.95 -27.93 60.38 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.02 0.528 . . . . 0.0 111.381 -179.01 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.501 ' HB2' ' O ' ' A' ' 15' ' ' ILE . 2.3 tpt180 -71.3 -41.98 69.26 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 123.622 0.577 . . . . 0.0 110.101 -178.217 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.621 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.5 pt20 -72.22 -30.35 64.83 Favored 'General case' 0 C--O 1.206 -1.22 0 CA-C-O 118.834 -0.603 . . . . 0.0 109.665 177.094 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.551 ' HB3' HH21 ' A' ' 25' ' ' ARG . 60.7 mtm-85 -68.43 -46.37 70.06 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.019 0.528 . . . . 0.0 111.999 179.66 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -63.58 -38.24 90.38 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 123.463 0.477 . . . . 0.0 110.428 177.385 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.565 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 81.5 mt -64.66 -48.77 73.57 Favored 'General case' 0 C--O 1.21 -0.981 0 O-C-N 123.495 0.497 . . . . 0.0 109.927 173.141 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.502 ' CE1' HD21 ' A' ' 66' ' ' LEU . 1.7 m-85 -57.41 -46.38 83.55 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.083 0.953 . . . . 0.0 110.871 -174.196 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.551 HH21 ' HB3' ' A' ' 21' ' ' ARG . 11.0 ptp180 -71.94 -28.11 63.24 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 122.747 0.419 . . . . 0.0 111.321 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 38.8 ttm180 -68.39 -56.52 8.21 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.435 0.694 . . . . 0.0 111.265 175.613 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 3.5 pp -80.88 -25.93 37.25 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.386 0.674 . . . . 0.0 111.51 -171.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.464 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 38.4 m80 . . . . . 0 N--CA 1.483 1.189 0 C-N-CA 122.866 0.466 . . . . 0.0 110.109 169.676 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.475 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 50.0 mt . . . . . 0 CA--C 1.55 0.959 0 N-CA-C 110.516 -0.179 . . . . 0.0 110.516 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 151.07 139.75 3.05 Favored Glycine 0 C--N 1.346 1.1 0 CA-C-O 119.711 -0.494 . . . . 0.0 111.889 -178.532 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -57.2 -63.89 1.07 Allowed 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.774 1.23 . . . . 0.0 113.18 -170.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 60.4 t -59.82 -33.81 53.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 C-N-CA 124.39 1.076 . . . . 0.0 110.759 -177.294 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.536 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -63.68 -54.96 27.81 Favored Glycine 0 C--O 1.215 -1.082 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.766 177.232 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -67.87 -37.42 81.79 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 124.363 1.065 . . . . 0.0 112.092 -174.058 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -67.81 -46.07 72.96 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 123.901 0.75 . . . . 0.0 110.472 -179.023 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -70.17 -35.08 73.74 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.1 178.003 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.536 ' HB2' ' O ' ' A' ' 62' ' ' GLY . 11.9 tp -60.3 -46.3 90.36 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 124.943 1.297 . . . . 0.0 110.459 -179.306 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -66.64 -39.74 88.41 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 124.632 1.207 . . . . 0.0 110.674 178.862 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.415 ' HB1' ' O ' ' A' ' 101' ' ' TYR . . . -64.03 -39.99 95.32 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.673 0.789 . . . . 0.0 110.849 179.282 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.621 HG21 ' HB3' ' A' ' 20' ' ' GLN . 89.4 mt -66.87 -46.03 86.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-N 114.841 -1.072 . . . . 0.0 109.745 176.361 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -65.03 -33.12 75.28 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.063 0.945 . . . . 0.0 111.271 -177.953 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.58 -44.07 75.18 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.626 0.77 . . . . 0.0 110.275 178.437 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.426 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -63.45 -49.97 71.56 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.893 178.573 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.453 HD23 HD12 ' A' ' 76' ' ' ILE . 69.1 mt -61.23 -38.24 85.93 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.805 1.242 . . . . 0.0 112.246 179.038 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.55 -42.54 98.99 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.423 0.689 . . . . 0.0 110.485 177.338 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 86.8 mtt-85 -75.24 -21.85 58.29 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 114.761 -1.109 . . . . 0.0 112.369 -178.673 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.453 HD12 HD23 ' A' ' 73' ' ' LEU . 89.6 mt -67.24 -47.82 80.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 171.78 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -67.2 -30.64 70.64 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.362 178.024 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 29.1 t -80.48 -23.6 40.06 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.652 0.781 . . . . 0.0 111.113 177.529 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 87.99 7.29 74.29 Favored Glycine 0 C--N 1.35 1.333 0 C-N-CA 123.039 0.352 . . . . 0.0 113.657 -178.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.3 t -113.12 29.03 8.31 Favored 'General case' 0 CA--C 1.556 1.2 0 C-N-CA 124.082 0.953 . . . . 0.0 110.413 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -64.22 146.12 54.83 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 122.729 0.412 . . . . 0.0 110.413 169.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.503 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 74.36 31.32 59.28 Favored Glycine 0 C--N 1.341 0.842 0 O-C-N 123.82 0.7 . . . . 0.0 112.298 -177.748 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 26.6 m -117.89 110.85 18.25 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 122.887 0.475 . . . . 0.0 110.215 176.887 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' CYS . . . . . 0.453 ' HB2' HD13 ' A' ' 91' ' ' ILE . 44.0 t -77.57 95.64 4.59 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.154 0.981 . . . . 0.0 110.101 174.728 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 30.9 m -62.56 -30.77 49.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 O-C-N 124.138 0.898 . . . . 0.0 113.077 -175.44 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.536 ' HD2' ' HB3' ' A' ' 108' ' ' CYS . 22.7 ttmm -60.56 -32.19 71.28 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.439 0.696 . . . . 0.0 112.535 -176.862 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.531 ' SG ' ' HB2' ' A' ' 89' ' ' LYS . 28.7 p -119.83 1.73 11.02 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 122.45 0.3 . . . . 0.0 111.273 175.342 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 62.76 20.82 62.38 Favored Glycine 0 C--N 1.351 1.39 0 CA-C-O 120.065 -0.297 . . . . 0.0 113.388 -177.069 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.531 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 11.0 mmpt? -106.46 177.06 4.97 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.48 0.712 . . . . 0.0 110.534 -176.689 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.503 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 21.8 tpp85 -78.83 144.97 34.53 Favored 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 124.197 0.999 . . . . 0.0 110.415 177.409 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.453 HD13 ' HB2' ' A' ' 84' ' ' CYS . 5.3 mm -79.94 144.89 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 168.297 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 19.7 m -74.55 149.31 40.23 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 110.403 -0.221 . . . . 0.0 110.403 178.748 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.443 ' HG2' ' HE3' ' A' ' 97' ' ' LYS . 30.6 tt0 -60.07 -42.96 95.68 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.854 0.862 . . . . 0.0 110.598 174.09 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -57.21 -43.7 83.03 Favored 'General case' 0 N--CA 1.482 1.151 0 O-C-N 124.497 1.123 . . . . 0.0 110.546 176.414 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.549 ' HG3' HG21 ' A' ' 102' ' ' THR . 26.5 tpt180 -64.43 -43.37 94.54 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 114.488 -1.233 . . . . 0.0 110.869 179.074 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 75.2 mt -71.46 -33.68 69.54 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.302 0.641 . . . . 0.0 112.624 -176.426 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.443 ' HE3' ' HG2' ' A' ' 93' ' ' GLU . 16.4 ptpt -79.75 -27.74 40.51 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 122.248 -0.283 . . . . 0.0 110.56 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -80.34 -33.66 37.22 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.859 0.864 . . . . 0.0 111.21 177.212 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.4 p -157.57 97.04 1.98 Allowed Pre-proline 0 CA--C 1.556 1.197 0 C-N-CA 124.78 1.232 . . . . 0.0 108.248 179.187 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -75.28 -8.81 20.06 Favored 'Trans proline' 0 C--N 1.377 2.067 0 C-N-CA 122.671 2.248 . . . . 0.0 113.724 -179.342 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' TYR . . . . . 0.415 ' O ' ' HB1' ' A' ' 68' ' ' ALA . 35.1 p90 -105.74 45.6 0.96 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.434 0.693 . . . . 0.0 110.991 -178.268 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.549 HG21 ' HG3' ' A' ' 95' ' ' ARG . 15.2 t -116.92 101.79 53.28 Favored Pre-proline 0 CA--C 1.564 1.508 0 CA-C-O 121.149 0.5 . . . . 0.0 110.216 -178.56 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' PRO . . . . . 0.436 ' O ' ' HA ' ' A' ' 84' ' ' CYS . 32.4 Cg_exo -64.83 -24.54 61.22 Favored 'Trans proline' 0 C--N 1.378 2.109 0 C-N-CA 122.898 2.399 . . . . 0.0 113.317 174.835 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.401 ' HA ' ' SG ' ' A' ' 84' ' ' CYS . 6.6 m-85 -114.64 148.74 37.71 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.833 0.853 . . . . 0.0 109.297 -178.694 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.452 ' SG ' ' OE1' ' A' ' 107' ' ' GLU . 28.5 p -83.54 165.7 18.87 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 -178.482 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -46.78 -41.86 16.06 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 124.793 1.237 . . . . 0.0 114.204 -162.91 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 0.452 ' OE1' ' SG ' ' A' ' 105' ' ' CYS . 0.0 OUTLIER -82.95 -23.61 33.37 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-O 120.647 0.261 . . . . 0.0 111.556 -175.982 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.536 ' HB3' ' HD2' ' A' ' 86' ' ' LYS . 97.7 m -76.54 -29.83 56.87 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.23 1.012 . . . . 0.0 110.951 174.288 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -78.13 -34.57 49.84 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.505 0.722 . . . . 0.0 109.866 174.46 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.55 -21.72 61.12 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.874 0.87 . . . . 0.0 111.151 174.549 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.773 0 C-N-CA 123.778 0.831 . . . . 0.0 111.733 176.248 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 62.6 t30 . . . . . 0 N--CA 1.478 0.936 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 99.4 t -59.4 -34.0 53.0 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.079 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.145 177.135 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -58.4 -43.81 88.76 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 124.465 1.106 . . . . 0.0 112.249 -179.294 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.9 m -57.68 -40.38 79.29 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.031 0.532 . . . . 0.0 110.262 177.588 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.516 ' HA ' HG22 ' A' ' 15' ' ' ILE . 25.2 m-85 -75.62 -34.81 60.59 Favored 'General case' 0 C--O 1.214 -0.799 0 CA-C-N 115.1 -0.955 . . . . 0.0 110.816 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -57.53 -53.23 60.45 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.407 1.083 . . . . 0.0 110.089 -177.834 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.423 ' NZ ' ' HB2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -71.72 -42.75 66.93 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.711 -176.701 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.516 HG22 ' HA ' ' A' ' 12' ' ' TYR . 11.6 tt -62.92 -34.25 65.11 Favored 'Isoleucine or valine' 0 C--N 1.37 1.489 0 CA-C-N 118.588 0.631 . . . . 0.0 110.083 -177.13 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.578 ' HB3' HG23 ' A' ' 69' ' ' ILE . 56.9 mt -65.13 -43.2 92.69 Favored 'General case' 0 C--N 1.345 0.406 0 C-N-CA 123.224 0.609 . . . . 0.0 110.898 175.827 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.423 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 97.4 mtt180 -63.87 -47.46 80.57 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 123.717 0.636 . . . . 0.0 111.88 177.884 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -63.71 -42.57 97.93 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 122.976 0.51 . . . . 0.0 111.204 -178.798 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -39.97 81.05 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.786 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.671 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.2 pt20 -70.16 -35.37 73.96 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 119.301 -0.381 . . . . 0.0 110.535 -178.706 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 71.1 mtp180 -69.47 -41.5 76.12 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.588 0.755 . . . . 0.0 111.363 -175.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -66.68 -34.41 77.81 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 175.164 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.602 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 86.1 mt -69.42 -38.53 77.94 Favored 'General case' 0 C--O 1.216 -0.671 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.924 174.763 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -60.85 -46.31 91.09 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 122.992 0.517 . . . . 0.0 110.304 -177.353 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 -69.95 -31.52 69.3 Favored 'General case' 0 N--CA 1.483 1.197 0 O-C-N 123.492 0.495 . . . . 0.0 110.634 178.814 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 21.7 ttt85 -62.38 -59.48 4.94 Favored 'General case' 0 C--N 1.361 1.091 0 C-N-CA 123.533 0.733 . . . . 0.0 111.439 177.191 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.602 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 1.1 pp -80.19 -24.48 40.28 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 112.505 0.558 . . . . 0.0 112.505 -173.36 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 . . . . . 0 N--CA 1.494 1.745 0 C-N-CA 123.04 0.536 . . . . 0.0 109.693 174.436 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.8 mt . . . . . 0 N--CA 1.472 0.651 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -70.3 149.08 46.68 Favored Glycine 0 N--CA 1.472 1.087 0 CA-C-O 119.227 -0.763 . . . . 0.0 112.45 -177.234 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -50.72 -60.31 3.18 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.725 1.21 . . . . 0.0 112.51 -175.269 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.43 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 12.4 p -56.81 -35.03 44.95 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 123.202 0.601 . . . . 0.0 111.377 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -67.86 -41.13 88.98 Favored Glycine 0 C--N 1.347 1.165 0 O-C-N 123.883 0.739 . . . . 0.0 112.665 177.383 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -68.87 -43.78 74.64 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.629 0.771 . . . . 0.0 110.695 -177.933 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -68.2 -33.09 73.78 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.588 0.755 . . . . 0.0 110.749 178.144 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.43 ' HB2' ' O ' ' A' ' 61' ' ' VAL . 2.7 tp10 -69.79 -46.75 65.05 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.609 179.608 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.7 mp -60.59 -39.44 88.1 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 124.356 1.035 . . . . 0.0 110.47 174.742 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 74.0 ttt180 -64.24 -39.61 94.31 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.311 -179.124 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.19 -43.11 65.02 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.921 0.889 . . . . 0.0 110.985 178.506 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.671 HG21 ' HB3' ' A' ' 20' ' ' GLN . 69.9 mt -64.5 -55.86 19.22 Favored 'Isoleucine or valine' 0 C--N 1.356 0.855 0 C-N-CA 123.507 0.723 . . . . 0.0 110.174 -177.845 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -66.71 -25.29 66.45 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.089 0.955 . . . . 0.0 112.304 -179.449 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.17 -51.93 58.09 Favored 'General case' 0 N--CA 1.482 1.175 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 171.07 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.525 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -60.43 -42.42 96.03 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.317 1.047 . . . . 0.0 111.007 -179.042 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.501 HD23 HD12 ' A' ' 76' ' ' ILE . 88.1 mt -64.19 -39.41 93.94 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 124.56 1.144 . . . . 0.0 111.619 178.537 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.12 -37.66 88.17 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.383 0.673 . . . . 0.0 110.558 175.502 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.407 HH12 HG21 ' A' ' 85' ' ' VAL . 69.6 mtt-85 -73.05 -26.44 61.29 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.701 0.8 . . . . 0.0 111.055 178.494 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.525 HG13 ' O ' ' A' ' 72' ' ' ALA . 90.0 mt -66.33 -48.76 79.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 174.915 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.62 -35.17 80.04 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.909 179.197 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.8 t -78.19 -14.94 59.25 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 123.794 0.837 . . . . 0.0 111.437 177.2 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 82.23 6.19 88.99 Favored Glycine 0 C--N 1.351 1.385 0 C-N-CA 123.24 0.448 . . . . 0.0 113.908 177.914 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.5 t -104.28 15.17 28.87 Favored 'General case' 0 CA--C 1.555 1.172 0 C-N-CA 124.311 1.045 . . . . 0.0 111.323 -177.308 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -67.16 151.85 46.81 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 169.795 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 72.29 20.58 79.3 Favored Glycine 0 C--N 1.344 1.009 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.775 -176.473 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 30.5 m -128.12 111.37 13.4 Favored 'General case' 0 C--N 1.353 0.742 0 C-N-CA 124.179 0.992 . . . . 0.0 109.65 178.516 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' CYS . . . . . 0.444 ' HB2' HD13 ' A' ' 91' ' ' ILE . 44.2 t -72.71 93.18 1.62 Allowed 'General case' 0 C--O 1.244 0.769 0 C-N-CA 123.878 0.871 . . . . 0.0 110.094 173.13 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.407 HG21 HH12 ' A' ' 75' ' ' ARG . 25.6 m -61.07 -24.4 32.97 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 CA-C-N 114.438 -1.255 . . . . 0.0 112.843 -178.939 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 47.7 tttm -71.9 -14.79 62.04 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.055 0.542 . . . . 0.0 112.116 -176.204 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.467 ' SG ' ' HB2' ' A' ' 89' ' ' LYS . 27.7 p -137.11 5.57 2.79 Favored 'General case' 0 N--CA 1.486 1.374 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 173.322 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 65.04 17.2 63.07 Favored Glycine 0 C--N 1.357 1.728 0 N-CA-C 113.819 0.288 . . . . 0.0 113.819 -178.364 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.467 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 31.8 mmmt -101.34 165.19 11.4 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.756 0.822 . . . . 0.0 109.415 -179.028 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 25.6 mmt180 -80.41 149.6 30.1 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 123.001 0.521 . . . . 0.0 110.42 172.079 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.444 HD13 ' HB2' ' A' ' 84' ' ' CYS . 5.3 mm -78.16 145.62 9.5 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 172.558 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 17.2 m -75.21 151.39 38.45 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.127 0.571 . . . . 0.0 109.744 177.868 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -64.25 -41.06 97.12 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 122.624 0.37 . . . . 0.0 110.672 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.456 ' HA ' ' HG2' ' A' ' 97' ' ' LYS . 24.7 m-20 -71.44 -31.71 67.51 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 123.771 0.67 . . . . 0.0 111.213 -179.465 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.422 ' HE ' HG21 ' A' ' 102' ' ' THR . 29.0 tpt180 -64.02 -37.17 86.44 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.433 0.693 . . . . 0.0 110.588 170.906 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 55.6 mt -77.68 -40.91 39.96 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.175 0.59 . . . . 0.0 112.278 -178.484 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.456 ' HG2' ' HA ' ' A' ' 94' ' ' ASP . 15.2 ptpt -70.79 -27.61 64.04 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-O 120.757 0.313 . . . . 0.0 110.223 -177.295 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.7 -50.69 8.99 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.693 0.797 . . . . 0.0 110.755 173.234 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.411 ' O ' HG22 ' A' ' 102' ' ' THR . 0.5 OUTLIER -130.2 86.0 55.34 Favored Pre-proline 0 CA--C 1.558 1.275 0 C-N-CA 124.087 0.955 . . . . 0.0 108.724 -175.449 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -77.89 -7.15 16.37 Favored 'Trans proline' 0 C--N 1.37 1.707 0 C-N-CA 122.383 2.055 . . . . 0.0 114.077 -177.905 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 16.3 p90 -103.12 -8.63 20.34 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -176.567 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.422 HG21 ' HE ' ' A' ' 95' ' ' ARG . 15.1 t -73.5 125.28 90.74 Favored Pre-proline 0 CA--C 1.56 1.331 0 CA-C-N 117.896 0.316 . . . . 0.0 110.398 -175.546 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -79.15 -7.91 15.25 Favored 'Trans proline' 0 C--N 1.371 1.724 0 C-N-CA 122.517 2.145 . . . . 0.0 111.98 172.382 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -116.32 140.08 49.71 Favored 'General case' 0 C--N 1.353 0.723 0 C-N-CA 123.855 0.862 . . . . 0.0 110.281 -175.157 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 20.6 p -75.43 167.09 22.56 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 174.508 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -50.55 -41.49 54.19 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.798 0.839 . . . . 0.0 112.106 -174.974 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -65.48 -44.27 87.64 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.2 1.0 . . . . 0.0 110.396 -175.549 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 86.8 m -69.26 -39.34 78.49 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.23 0.612 . . . . 0.0 111.103 177.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.88 -30.99 71.68 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.576 0.75 . . . . 0.0 111.399 177.823 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -74.46 -34.69 63.21 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.893 0.877 . . . . 0.0 110.598 174.314 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.548 0.893 0 C-N-CA 123.881 0.872 . . . . 0.0 111.939 178.489 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.606 ' N ' HD21 ' A' ' 8' ' ' ASN . 0.0 OUTLIER . . . . . 0 CA--C 1.548 0.874 0 CA-C-O 121.9 0.857 . . . . 0.0 110.273 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 42.5 t -69.69 -27.56 34.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.485 -179.302 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -52.98 -38.49 62.24 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.073 0.949 . . . . 0.0 111.695 179.399 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 16.6 m -60.42 -43.48 96.71 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.932 175.887 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.459 ' HA ' HG22 ' A' ' 15' ' ' ILE . 25.4 m-85 -72.18 -32.69 67.05 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.996 179.663 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.608 ' HG2' HD13 ' A' ' 76' ' ' ILE . 39.5 mt-10 -59.3 -56.25 24.44 Favored 'General case' 0 N--CA 1.492 1.636 0 CA-C-O 121.434 0.635 . . . . 0.0 110.809 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -66.47 -44.44 82.71 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.134 -176.01 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.459 HG22 ' HA ' ' A' ' 12' ' ' TYR . 10.3 tt -67.49 -32.7 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.242 0 C-N-CA 122.514 0.326 . . . . 0.0 110.574 -174.861 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.535 ' HB3' HG23 ' A' ' 69' ' ' ILE . 31.2 mt -65.2 -46.09 82.15 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.093 0.557 . . . . 0.0 110.635 175.103 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 51.2 mtm-85 -63.82 -41.91 97.77 Favored 'General case' 0 C--O 1.217 -0.628 0 O-C-N 123.605 0.566 . . . . 0.0 110.81 179.402 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -61.54 -36.27 80.1 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.317 0.647 . . . . 0.0 111.218 177.757 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -81.15 -28.84 34.89 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.258 -178.535 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.642 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.4 pt20 -78.04 -25.09 47.62 Favored 'General case' 0 C--O 1.207 -1.16 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 173.546 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 72.9 mtt180 -66.82 -49.48 65.67 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.056 0.542 . . . . 0.0 110.589 176.452 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -65.75 -37.46 86.42 Favored 'General case' 0 N--CA 1.478 0.968 0 O-C-N 123.533 0.521 . . . . 0.0 110.88 178.549 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.59 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 58.0 mt -67.96 -46.23 71.97 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 119.155 -0.45 . . . . 0.0 111.147 175.411 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.422 ' O ' ' HB2' ' A' ' 28' ' ' HIS . 3.8 m-85 -58.13 -50.53 73.18 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.173 0.589 . . . . 0.0 110.094 -177.579 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 19.7 ptt180 -68.79 -28.15 66.51 Favored 'General case' 0 N--CA 1.48 1.057 0 O-C-N 123.525 0.515 . . . . 0.0 111.172 -178.587 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 14.8 ttm180 -62.97 -59.05 5.35 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.083 0.553 . . . . 0.0 110.403 175.882 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.59 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 1.6 pp -80.99 -8.37 59.76 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.986 -176.761 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.422 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 17.9 m170 . . . . . 0 N--CA 1.479 0.997 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 170.83 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.535 HD22 HD13 ' A' ' 27' ' ' LEU . 4.6 mt . . . . . 0 N--CA 1.476 0.86 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -97.53 161.71 21.36 Favored Glycine 0 N--CA 1.478 1.452 0 CA-C-O 119.493 -0.615 . . . . 0.0 112.181 173.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -64.77 -64.3 0.91 Allowed 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.231 0.612 . . . . 0.0 111.722 -173.145 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 9.3 p -59.32 -29.76 42.64 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 C-N-CA 123.89 0.876 . . . . 0.0 110.726 177.618 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.522 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -60.45 -51.73 56.96 Favored Glycine 0 C--N 1.348 1.25 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.164 175.956 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -69.9 -40.72 75.45 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.714 0.806 . . . . 0.0 112.024 -177.307 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -67.04 -44.05 81.19 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 123.92 0.763 . . . . 0.0 110.264 -174.965 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -70.43 -38.44 74.57 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.235 177.277 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.554 HD22 HD21 ' A' ' 27' ' ' LEU . 14.9 tp -58.23 -46.26 86.22 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 124.738 1.215 . . . . 0.0 111.137 178.525 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 31.1 ttt180 -75.94 -31.84 59.28 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 114.004 -1.453 . . . . 0.0 110.024 -175.054 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -68.28 -39.35 82.17 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 123.915 0.759 . . . . 0.0 110.717 174.533 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.642 HG21 ' HB3' ' A' ' 20' ' ' GLN . 80.9 mt -63.51 -47.7 90.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.523 0.729 . . . . 0.0 109.569 175.46 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -63.37 -35.59 80.91 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.813 -179.07 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.15 -39.99 75.02 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.757 0.823 . . . . 0.0 110.971 177.973 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.498 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -68.1 -43.3 78.78 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.61 0.764 . . . . 0.0 110.746 -179.699 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 84.7 mt -61.38 -39.11 89.46 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.288 1.035 . . . . 0.0 111.164 175.824 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.61 -37.12 86.49 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.624 175.746 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 67.3 mtt85 -69.98 -29.04 66.03 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.599 0.76 . . . . 0.0 111.509 176.701 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.608 HD13 ' HG2' ' A' ' 13' ' ' GLU . 62.3 mt -70.3 -44.79 77.3 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 177.394 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.89 -27.41 67.48 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 115.329 -0.851 . . . . 0.0 111.218 176.513 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.9 t -84.13 -18.23 37.46 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.729 0.812 . . . . 0.0 110.804 174.979 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 82.42 7.94 86.91 Favored Glycine 0 C--N 1.348 1.229 0 C-N-CA 123.084 0.373 . . . . 0.0 113.937 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.2 t -112.95 31.32 6.49 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 124.196 0.998 . . . . 0.0 110.402 -179.029 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -64.5 146.55 54.39 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.714 170.509 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.478 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 73.16 37.03 55.76 Favored Glycine 0 C--N 1.343 0.933 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.955 -177.933 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 41.0 m -121.73 116.27 24.21 Favored 'General case' 0 C--O 1.242 0.679 0 C-N-CA 123.279 0.632 . . . . 0.0 109.668 177.782 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 44.4 t -67.33 102.29 1.07 Allowed 'General case' 0 C--N 1.349 0.563 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 169.076 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 33.7 m -63.43 -30.28 49.39 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 O-C-N 124.242 0.964 . . . . 0.0 111.947 -177.802 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -73.66 -13.7 61.03 Favored 'General case' 0 CA--C 1.557 1.241 0 C-N-CA 123.609 0.763 . . . . 0.0 111.432 177.551 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 57.5 m -111.17 -23.29 10.96 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.768 0.827 . . . . 0.0 111.534 175.038 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 64.56 20.87 66.34 Favored Glycine 0 CA--C 1.537 1.464 0 CA-C-N 116.545 -0.298 . . . . 0.0 112.986 -165.877 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 46.6 mtmt -126.89 -177.56 4.07 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.978 0.911 . . . . 0.0 110.491 -172.368 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.478 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 18.7 tpp180 -72.9 152.67 41.34 Favored 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 124.663 1.185 . . . . 0.0 111.658 -178.192 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 17.6 mm -92.72 149.68 4.11 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.017 0 C-N-CA 124.978 1.311 . . . . 0.0 109.406 170.371 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.3 m -64.59 145.13 56.61 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 122.965 0.506 . . . . 0.0 110.25 174.74 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -58.5 -42.81 88.51 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.257 0.623 . . . . 0.0 110.839 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.501 ' HA ' ' HG2' ' A' ' 97' ' ' LYS . 16.2 m-20 -68.31 -33.11 73.73 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.83 -179.659 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.409 ' HG3' HG21 ' A' ' 102' ' ' THR . 24.6 tpt180 -68.35 -31.78 71.42 Favored 'General case' 0 CA--C 1.547 0.864 0 O-C-N 123.635 0.584 . . . . 0.0 110.217 173.785 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.41 HD21 ' HA2' ' A' ' 82' ' ' GLY . 90.9 mt -80.34 -37.06 33.21 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 118.189 0.45 . . . . 0.0 112.171 179.447 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.501 ' HG2' ' HA ' ' A' ' 94' ' ' ASP . 16.5 ptpt -75.32 -28.66 59.74 Favored 'General case' 0 N--CA 1.485 1.296 0 CA-C-O 120.882 0.373 . . . . 0.0 110.077 -177.514 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -91.37 -41.37 10.94 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.721 0.809 . . . . 0.0 111.296 178.736 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 3.8 t -132.54 76.04 72.49 Favored Pre-proline 0 CA--C 1.56 1.357 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 -175.516 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -74.02 0.9 7.77 Favored 'Trans proline' 0 C--N 1.373 1.84 0 C-N-CA 122.579 2.186 . . . . 0.0 114.123 -174.001 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 22.8 p90 -108.18 -8.61 15.72 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.445 0.698 . . . . 0.0 112.599 -176.984 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.409 HG21 ' HG3' ' A' ' 95' ' ' ARG . 14.7 t -65.62 123.18 83.91 Favored Pre-proline 0 CA--C 1.566 1.578 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -170.906 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -76.47 -19.23 15.05 Favored 'Trans proline' 0 C--N 1.377 2.05 0 C-N-CA 122.482 2.121 . . . . 0.0 112.041 171.255 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.401 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 6.9 m-85 -113.02 162.93 15.32 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.848 0.859 . . . . 0.0 109.766 -176.191 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 31.1 p -92.32 168.38 11.35 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 175.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -55.13 -32.46 62.09 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.618 0.767 . . . . 0.0 111.905 -178.72 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -67.74 -45.29 75.4 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.757 0.823 . . . . 0.0 109.917 178.856 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.401 ' HB2' ' HB3' ' A' ' 104' ' ' PHE . 91.6 m -69.65 -30.61 68.34 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.411 177.822 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.0 -32.4 74.1 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.419 0.688 . . . . 0.0 110.772 173.824 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -80.79 -21.16 41.2 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.588 0.755 . . . . 0.0 111.3 173.799 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.142 0 C-N-CA 123.745 0.818 . . . . 0.0 112.47 -178.718 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 16.4 m120 . . . . . 0 N--CA 1.473 0.703 0 CA-C-O 121.699 0.761 . . . . 0.0 109.054 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 44.3 t -65.24 -26.04 38.71 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-N 114.35 -1.295 . . . . 0.0 111.795 -170.391 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -61.87 -31.02 71.26 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.351 0.66 . . . . 0.0 112.572 179.353 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.4 m -66.96 -40.24 87.44 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 121.395 0.617 . . . . 0.0 109.869 172.528 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -72.64 -30.24 64.14 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.749 178.74 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.529 ' HG2' HD13 ' A' ' 76' ' ' ILE . 41.2 mt-10 -66.49 -52.44 45.97 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 122.95 0.5 . . . . 0.0 110.385 -179.254 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -65.39 -41.56 93.58 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 123.938 0.774 . . . . 0.0 111.687 -176.712 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 12.0 tt -65.0 -34.82 73.2 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 CA-C-O 120.727 0.298 . . . . 0.0 110.281 -178.855 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.5 mt -69.24 -38.26 78.4 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 122.77 0.428 . . . . 0.0 111.119 176.161 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -58.83 -50.41 74.09 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.005 0.522 . . . . 0.0 110.268 175.276 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -61.35 -47.9 83.76 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.451 0.7 . . . . 0.0 111.669 -179.574 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.77 -40.69 98.08 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.452 0.701 . . . . 0.0 111.404 -178.203 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.666 ' HB3' HG21 ' A' ' 69' ' ' ILE . 3.0 pt20 -76.05 -32.34 59.26 Favored 'General case' 0 C--O 1.214 -0.815 0 CA-C-O 119.045 -0.502 . . . . 0.0 111.432 -177.698 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.0 mmt180 -76.24 -36.01 58.71 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 117.97 0.35 . . . . 0.0 111.365 -176.024 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -67.93 -41.19 82.96 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 174.94 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.51 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 75.6 mt -65.5 -43.02 91.47 Favored 'General case' 0 C--N 1.354 0.78 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.391 174.39 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -58.36 -54.0 51.98 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.862 0.865 . . . . 0.0 110.702 -175.561 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.9 ptt180 -69.11 -27.61 65.73 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 123.742 0.651 . . . . 0.0 111.224 -178.423 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 44.0 ttt85 -66.23 -58.32 5.65 Favored 'General case' 0 C--N 1.362 1.11 0 C-N-CA 122.919 0.488 . . . . 0.0 111.269 176.363 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.638 HD21 HD22 ' A' ' 66' ' ' LEU . 4.0 pp -72.76 -26.52 61.58 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 122.86 0.464 . . . . 0.0 111.022 -175.611 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 20.0 m80 . . . . . 0 N--CA 1.484 1.25 0 C-N-CA 123.095 0.558 . . . . 0.0 111.376 173.012 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.447 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 59.8 mt . . . . . 0 CA--C 1.546 0.82 0 N-CA-C 110.597 -0.149 . . . . 0.0 110.597 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 129.7 124.7 2.65 Favored Glycine 0 N--CA 1.474 1.227 0 N-CA-C 111.375 -0.69 . . . . 0.0 111.375 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -66.05 -38.19 87.73 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -164.765 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 6.1 p -62.36 -39.4 84.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 CA-C-N 118.399 0.545 . . . . 0.0 110.692 177.741 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.481 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -66.39 -49.89 53.66 Favored Glycine 0 C--N 1.344 0.98 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.632 176.463 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -67.23 -35.72 80.14 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 124.593 1.157 . . . . 0.0 112.24 -174.988 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -73.11 -48.69 33.52 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.577 -176.063 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -64.96 -34.57 78.73 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 115.013 -0.994 . . . . 0.0 109.74 177.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.638 HD22 HD21 ' A' ' 27' ' ' LEU . 13.9 tp -60.84 -46.02 92.23 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.691 1.197 . . . . 0.0 109.911 175.517 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 51.7 ttt180 -61.92 -38.09 87.12 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.172 0.989 . . . . 0.0 110.93 -178.469 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.16 -43.26 99.17 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 123.81 0.694 . . . . 0.0 110.253 176.093 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.666 HG21 ' HB3' ' A' ' 20' ' ' GLN . 85.1 mt -65.2 -45.49 93.69 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.871 179.076 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -66.14 -33.09 74.98 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.912 0.885 . . . . 0.0 111.123 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.58 -35.89 73.28 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.093 0.957 . . . . 0.0 110.243 177.192 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.431 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -68.44 -47.28 67.59 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.64 177.348 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.505 HD23 HD12 ' A' ' 76' ' ' ILE . 88.2 mt -63.24 -33.76 76.19 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 124.192 0.997 . . . . 0.0 111.491 177.115 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.0 -41.24 95.57 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.667 0.787 . . . . 0.0 110.355 175.702 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 89.1 mtm180 -68.82 -30.43 68.97 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.382 0.673 . . . . 0.0 111.604 176.365 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.529 HD13 ' HG2' ' A' ' 13' ' ' GLU . 75.1 mt -68.99 -42.63 82.22 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 176.499 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.53 -34.25 77.81 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.767 176.28 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.8 t -82.0 -12.79 58.14 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 124.035 0.934 . . . . 0.0 111.114 178.268 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 75.71 9.64 84.88 Favored Glycine 0 C--N 1.353 1.521 0 C-N-CA 123.086 0.375 . . . . 0.0 113.627 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 15.2 t -112.42 28.18 9.0 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.24 1.016 . . . . 0.0 109.774 -177.915 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -66.45 144.41 56.51 Favored 'General case' 0 C--N 1.348 0.527 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.901 172.291 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.585 ' HA2' HD21 ' A' ' 96' ' ' LEU . . . 77.87 37.27 30.12 Favored Glycine 0 C--N 1.34 0.77 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.769 -172.256 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 93.9 m -123.79 118.26 26.77 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.557 0.743 . . . . 0.0 110.586 177.181 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' CYS . . . . . 0.667 ' SG ' ' SG ' ' A' ' 105' ' ' CYS . 48.8 t -62.02 92.85 0.04 OUTLIER 'General case' 0 C--N 1.352 0.699 0 C-N-CA 124.927 1.291 . . . . 0.0 108.239 166.725 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 33.1 m -62.88 -27.33 42.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 124.003 0.921 . . . . 0.0 112.25 -173.211 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 59.4 tttm -70.48 -20.63 62.85 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.25 1.02 . . . . 0.0 111.573 178.681 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.544 ' SG ' ' SG ' ' A' ' 84' ' ' CYS . 11.8 m -120.48 -13.54 8.79 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 123.959 0.903 . . . . 0.0 111.342 -174.172 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 60.83 31.6 76.42 Favored Glycine 0 C--N 1.353 1.473 0 CA-C-N 116.48 -0.327 . . . . 0.0 113.266 -173.742 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -135.74 -174.49 3.67 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.761 0.824 . . . . 0.0 110.691 -176.422 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.471 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 4.3 tpp180 -74.7 151.93 39.17 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.854 0.862 . . . . 0.0 112.918 -169.885 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 23.9 mm -95.48 148.85 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 124.345 1.058 . . . . 0.0 108.513 167.938 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.4 m -71.75 145.46 48.74 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.643 0.777 . . . . 0.0 110.05 177.578 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -58.32 -41.03 83.65 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.245 0.618 . . . . 0.0 110.929 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -62.55 -38.97 92.11 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.324 1.05 . . . . 0.0 111.101 179.318 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.447 ' HE ' HG21 ' A' ' 102' ' ' THR . 25.5 tpt180 -69.66 -33.46 72.62 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.74 178.604 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.585 HD21 ' HA2' ' A' ' 82' ' ' GLY . 87.0 mt -73.17 -45.23 57.77 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 122.817 0.447 . . . . 0.0 111.421 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -71.32 -28.46 64.11 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 122.808 0.443 . . . . 0.0 110.938 -175.747 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -88.34 -47.16 8.6 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.336 0.654 . . . . 0.0 111.058 178.517 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 1.7 t -129.87 79.66 72.81 Favored Pre-proline 0 CA--C 1.559 1.308 0 C-N-CA 124.029 0.931 . . . . 0.0 108.639 -175.84 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -73.37 -8.17 21.45 Favored 'Trans proline' 0 C--N 1.372 1.774 0 C-N-CA 122.285 1.99 . . . . 0.0 113.445 -177.401 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 26.6 p90 -100.86 -8.69 22.35 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -176.75 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.447 HG21 ' HE ' ' A' ' 95' ' ' ARG . 13.8 t -62.06 122.17 70.57 Favored Pre-proline 0 CA--C 1.563 1.443 0 O-C-N 123.129 0.268 . . . . 0.0 111.365 -172.152 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -66.44 -37.85 21.75 Favored 'Trans proline' 0 C--N 1.376 2.026 0 C-N-CA 122.461 2.107 . . . . 0.0 111.371 173.411 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -99.57 -179.49 4.22 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.694 -178.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.732 ' SG ' ' HB2' ' A' ' 108' ' ' CYS . 15.0 p -98.71 179.64 4.6 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 124.875 1.27 . . . . 0.0 109.227 173.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -64.86 -55.51 19.04 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 118.051 0.387 . . . . 0.0 111.459 -177.348 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.06 -34.25 76.08 Favored 'General case' 0 N--CA 1.483 1.225 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -175.068 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.732 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 68.3 m -81.04 -22.95 38.91 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 179.433 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -78.74 -24.23 44.94 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 171.439 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -81.87 -27.4 33.5 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.605 0.762 . . . . 0.0 110.797 172.951 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.677 0 C-N-CA 124.137 0.975 . . . . 0.0 109.959 -179.859 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.409 HD13 ' OG1' ' A' ' 83' ' ' THR . 8.2 tt . . . . . 0 N--CA 1.478 0.971 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -78.98 99.12 6.7 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 174.013 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -157.71 73.19 0.23 Allowed Glycine 0 C--N 1.345 1.083 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -178.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -76.73 -35.38 40.56 Favored Glycine 0 C--N 1.347 1.192 0 O-C-N 123.837 0.375 . . . . 0.0 113.043 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -83.75 156.68 22.43 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.318 0.647 . . . . 0.0 110.472 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 67.4 m 68.69 134.88 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.635 1.574 . . . . 0.0 112.122 -176.43 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' MET . . . . . 0.474 ' HG3' HD12 ' A' ' 96' ' ' LEU . 15.4 tmm? 64.98 93.86 0.06 Allowed 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.401 1.081 . . . . 0.0 110.539 179.532 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -71.35 99.92 2.06 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.837 -175.487 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 59.8 t -59.25 -35.7 59.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 124.039 0.936 . . . . 0.0 112.113 -174.56 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -56.51 -43.31 79.64 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.361 0.664 . . . . 0.0 111.601 -174.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.8 m -58.17 -43.8 87.65 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 123.989 0.806 . . . . 0.0 110.798 178.541 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.518 ' HA ' HG22 ' A' ' 15' ' ' ILE . 36.6 m-85 -74.24 -37.22 63.86 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.989 -176.675 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -57.59 -51.31 70.0 Favored 'General case' 0 C--O 1.244 0.802 0 C-N-CA 124.823 1.249 . . . . 0.0 110.497 -177.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.415 ' NZ ' ' HB2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -71.49 -42.45 68.03 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.276 -0.875 . . . . 0.0 111.568 -177.661 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.518 HG22 ' HA ' ' A' ' 12' ' ' TYR . 9.2 tt -67.68 -28.52 42.02 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 CA-C-N 118.474 0.579 . . . . 0.0 110.723 -177.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 42.1 mt -63.12 -47.41 82.93 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.299 0.64 . . . . 0.0 110.27 172.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.52 ' O ' ' HG3' ' A' ' 21' ' ' ARG . 48.2 mtm105 -62.57 -42.56 99.62 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 123.953 0.783 . . . . 0.0 111.229 176.186 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -59.74 -45.4 92.31 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 122.889 0.476 . . . . 0.0 110.198 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? -67.28 -42.11 84.34 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.776 -177.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.67 ' HB3' HG21 ' A' ' 69' ' ' ILE . 3.2 pt20 -71.13 -36.0 71.93 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-O 118.82 -0.609 . . . . 0.0 110.531 -174.621 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.617 ' HG2' ' HG2' ' A' ' 48' ' ' GLU . 53.7 mtp180 -75.67 -39.6 57.33 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 123.791 0.682 . . . . 0.0 111.934 -173.27 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -64.2 -40.02 95.2 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 123.459 0.475 . . . . 0.0 109.869 174.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.508 ' HB2' HD11 ' A' ' 66' ' ' LEU . 98.8 mt -72.78 -29.82 63.6 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.44 175.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.434 ' HB2' ' HA ' ' A' ' 21' ' ' ARG . 1.4 m-85 -65.5 -54.79 23.29 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.478 0.711 . . . . 0.0 109.498 178.64 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -66.35 -27.29 67.77 Favored 'General case' 0 N--CA 1.482 1.164 0 O-C-N 123.939 0.774 . . . . 0.0 110.758 -177.511 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -58.77 -52.76 64.35 Favored 'General case' 0 C--N 1.356 0.882 0 O-C-N 124.077 0.86 . . . . 0.0 110.695 173.244 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 3.2 pp -87.32 -11.79 48.43 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 31.0 m170 -92.66 17.29 10.48 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 123.866 0.866 . . . . 0.0 110.835 175.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.58 -27.27 25.61 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 124.001 0.92 . . . . 0.0 112.523 177.668 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.464 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -67.32 -40.61 85.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 123.601 0.761 . . . . 0.0 111.721 179.062 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.423 ' N ' HG12 ' A' ' 30' ' ' ILE . 12.5 pt-20 -106.07 -4.96 19.83 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.995 0.918 . . . . 0.0 111.418 -173.186 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -124.6 99.77 6.33 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.403 0.681 . . . . 0.0 109.468 -179.208 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -70.1 -31.69 69.38 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.47 0.708 . . . . 0.0 109.93 171.254 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -78.41 119.84 22.3 Favored 'General case' 0 C--O 1.244 0.811 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.403 -178.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -125.36 -16.62 5.85 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 123.382 0.673 . . . . 0.0 110.373 176.009 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 65.04 147.92 0.11 Allowed Pre-proline 0 CA--C 1.566 1.564 0 C-N-CA 125.979 1.711 . . . . 0.0 112.5 -175.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -57.99 -58.04 0.94 Allowed 'Trans proline' 0 C--N 1.383 2.389 0 C-N-CA 122.565 2.177 . . . . 0.0 111.704 171.179 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 80.2 mmt-85 -132.89 -84.56 0.47 Allowed 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.86 0.864 . . . . 0.0 109.336 174.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 37.6 p30 -72.96 157.88 87.99 Favored Pre-proline 0 N--CA 1.482 1.147 0 C-N-CA 123.879 0.872 . . . . 0.0 111.49 -173.202 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -65.56 -13.16 38.4 Favored 'Trans proline' 0 C--N 1.38 2.236 0 C-N-CA 122.411 2.074 . . . . 0.0 112.936 172.004 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 22.3 t70 77.2 -65.59 0.27 Allowed 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 125.966 1.706 . . . . 0.0 110.414 -176.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -78.61 -173.83 3.58 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.954 0.902 . . . . 0.0 111.039 178.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -62.54 -64.0 1.06 Allowed 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 123.853 0.861 . . . . 0.0 111.135 -178.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -174.77 136.91 0.43 Allowed 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.646 0.778 . . . . 0.0 110.392 -172.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 18.4 mmt180 -91.34 86.62 6.17 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 174.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.32 78.03 2.41 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-O 121.639 0.733 . . . . 0.0 110.81 -177.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 39.2 m -147.19 23.55 1.17 Allowed 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.858 1.263 . . . . 0.0 109.03 177.334 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.617 ' HG2' ' HG2' ' A' ' 21' ' ' ARG . 9.1 tp10 -84.85 148.64 26.18 Favored 'General case' 0 C--N 1.349 0.576 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.298 -171.433 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 42.6 ttp180 58.49 23.1 10.36 Favored 'General case' 0 CA--C 1.564 1.509 0 C-N-CA 124.833 1.253 . . . . 0.0 111.144 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.8 t -85.83 -9.42 57.05 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.152 0.981 . . . . 0.0 110.988 -176.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -96.26 99.97 11.64 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 179.461 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -90.58 68.27 6.59 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 121.972 0.892 . . . . 0.0 109.169 177.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -139.46 159.9 41.08 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 124.456 1.102 . . . . 0.0 109.284 174.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 93.6 t -78.12 -64.34 0.92 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 C-N-CA 123.36 0.664 . . . . 0.0 109.423 175.282 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.3 tp 57.17 117.75 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 125.655 1.582 . . . . 0.0 113.219 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -74.98 -21.09 59.36 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 124.139 0.976 . . . . 0.0 111.386 -175.551 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -71.09 -16.85 62.6 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.075 0.55 . . . . 0.0 112.341 177.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.501 ' HB2' ' NE2' ' A' ' 63' ' ' GLN . 18.1 mt -75.02 130.92 40.16 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 173.834 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -59.4 124.98 38.15 Favored Glycine 0 C--N 1.353 1.492 0 CA-C-O 118.808 -0.995 . . . . 0.0 111.521 177.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -62.49 -32.71 73.66 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 123.552 0.741 . . . . 0.0 112.22 -174.388 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.434 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 8.7 p -62.84 -39.04 83.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 123.251 0.62 . . . . 0.0 110.156 174.318 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -73.23 -43.11 40.3 Favored Glycine 0 C--N 1.348 1.198 0 O-C-N 123.686 0.616 . . . . 0.0 111.969 179.121 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.501 ' NE2' ' HB2' ' A' ' 58' ' ' LEU . 99.4 mt-30 -59.89 -45.34 92.84 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.028 0.931 . . . . 0.0 110.725 177.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -67.7 -40.57 84.31 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.121 0.968 . . . . 0.0 110.474 -178.622 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.434 ' HB2' ' O ' ' A' ' 61' ' ' VAL . 3.1 tp10 -65.15 -42.1 94.1 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.624 178.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.508 HD11 ' HB2' ' A' ' 23' ' ' LEU . 0.8 OUTLIER -70.31 -29.97 66.84 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.693 1.197 . . . . 0.0 111.35 179.927 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 41.9 ttt180 -69.4 -38.69 78.07 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 123.856 0.722 . . . . 0.0 109.665 175.32 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.85 -37.55 76.17 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.675 0.79 . . . . 0.0 111.038 177.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.67 HG21 ' HB3' ' A' ' 20' ' ' GLN . 98.7 mt -68.95 -40.29 80.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 123.61 0.764 . . . . 0.0 110.016 175.303 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -66.74 -39.21 87.86 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.7 0.8 . . . . 0.0 110.17 -178.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.58 -41.85 92.42 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.632 0.773 . . . . 0.0 110.493 176.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.433 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -65.28 -45.82 82.9 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.874 0.869 . . . . 0.0 111.186 179.463 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.498 HD23 HD12 ' A' ' 76' ' ' ILE . 80.5 mt -65.53 -31.99 73.34 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.161 0.984 . . . . 0.0 111.222 177.278 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.6 -34.07 69.56 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.479 0.712 . . . . 0.0 110.951 177.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -65.38 -36.19 83.22 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.006 0.522 . . . . 0.0 110.213 172.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.498 HD12 HD23 ' A' ' 73' ' ' LEU . 55.8 mt -66.68 -43.7 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 177.424 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.83 -30.44 71.49 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.533 1.133 . . . . 0.0 111.539 175.175 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.9 t -85.07 -17.27 37.92 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.833 0.853 . . . . 0.0 111.115 177.109 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 82.15 13.29 79.37 Favored Glycine 0 C--N 1.347 1.188 0 C-N-CA 123.412 0.53 . . . . 0.0 113.549 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 12.4 t -125.14 33.39 5.18 Favored 'General case' 0 CA--C 1.556 1.18 0 C-N-CA 124.176 0.99 . . . . 0.0 110.718 -177.266 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -62.84 144.32 56.72 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 121.91 -0.494 . . . . 0.0 110.087 165.589 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.21 31.06 32.34 Favored Glycine 0 C--N 1.341 0.848 0 O-C-N 123.965 0.791 . . . . 0.0 111.359 -171.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' THR . . . . . 0.409 ' OG1' HD13 ' A' ' 1' ' ' LEU . 9.7 m -130.46 114.55 15.67 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.717 0.807 . . . . 0.0 110.203 175.34 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 44.1 t -61.13 106.16 0.57 Allowed 'General case' 0 C--N 1.351 0.667 0 C-N-CA 124.101 0.96 . . . . 0.0 109.131 170.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 26.8 m -59.09 -31.01 44.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 O-C-N 124.236 0.96 . . . . 0.0 110.995 177.107 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 36.0 tttm -80.22 -7.56 59.04 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.084 0.953 . . . . 0.0 111.624 -176.051 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 62.8 m -119.83 -24.25 6.2 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 124.023 0.929 . . . . 0.0 111.91 174.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 65.04 27.8 72.74 Favored Glycine 0 CA--C 1.537 1.461 0 O-C-N 123.423 0.452 . . . . 0.0 112.103 -165.274 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -134.42 172.94 12.2 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.747 0.819 . . . . 0.0 110.133 -171.469 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.54 151.71 44.77 Favored 'General case' 0 CA--C 1.573 1.838 0 C-N-CA 124.377 1.071 . . . . 0.0 111.468 -172.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 8.7 mm -99.21 152.09 4.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 C-N-CA 125.237 1.415 . . . . 0.0 109.807 174.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.1 m -72.33 142.76 48.82 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 122.985 0.514 . . . . 0.0 109.737 173.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 46.2 tt0 -66.47 -32.14 73.32 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.866 0.466 . . . . 0.0 110.211 175.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.434 ' HA ' ' HE3' ' A' ' 97' ' ' LYS . 35.7 m-20 -66.83 -34.95 78.94 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.737 0.815 . . . . 0.0 111.393 175.712 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -60.77 -45.15 95.46 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 123.948 0.78 . . . . 0.0 110.297 173.684 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.474 HD12 ' HG3' ' A' ' 7' ' ' MET . 98.3 mt -81.64 -27.25 34.21 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 -173.354 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.434 ' HE3' ' HA ' ' A' ' 94' ' ' ASP . 16.9 ptpt -73.69 -31.39 63.41 Favored 'General case' 0 N--CA 1.483 1.207 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 177.384 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.44 -43.36 19.01 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.769 0.828 . . . . 0.0 110.838 176.299 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.2 p -150.18 94.88 3.67 Favored Pre-proline 0 CA--C 1.556 1.179 0 C-N-CA 124.477 1.111 . . . . 0.0 109.325 -178.021 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -76.05 -10.14 19.47 Favored 'Trans proline' 0 C--N 1.379 2.173 0 C-N-CA 122.574 2.183 . . . . 0.0 112.967 177.185 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' TYR . . . . . 0.42 ' HB3' HG12 ' A' ' 69' ' ' ILE . 15.3 p90 -101.8 48.91 0.87 Allowed 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.835 0.854 . . . . 0.0 110.545 -176.704 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 10.1 t -129.77 116.22 18.13 Favored Pre-proline 0 CA--C 1.55 0.968 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.383 171.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -76.16 -0.06 9.91 Favored 'Trans proline' 0 C--N 1.372 1.792 0 C-N-CA 122.348 2.032 . . . . 0.0 111.933 170.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.427 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 9.6 m-85 -115.56 146.36 41.81 Favored 'General case' 0 C--N 1.351 0.668 0 C-N-CA 123.974 0.909 . . . . 0.0 109.39 -176.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.418 ' SG ' ' HB2' ' A' ' 107' ' ' GLU . 23.4 p -77.11 162.87 27.12 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 172.56 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -59.87 -29.95 68.66 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 118.21 0.459 . . . . 0.0 111.881 -174.352 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.418 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 33.7 mt-10 -55.55 -52.3 64.18 Favored 'General case' 0 N--CA 1.481 1.101 0 O-C-N 123.986 0.804 . . . . 0.0 110.586 171.437 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.427 ' HB2' ' HB3' ' A' ' 104' ' ' PHE . 93.2 m -68.53 -39.59 81.1 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.278 178.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -63.43 -36.63 84.36 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.774 0.83 . . . . 0.0 111.115 -177.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -81.24 -22.36 38.79 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.71 0.804 . . . . 0.0 110.865 177.157 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -88.0 -7.75 56.61 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.838 0.855 . . . . 0.0 112.367 178.414 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 108' ' ' CYS . 84.0 mt . . . . . 0 N--CA 1.481 1.115 0 CA-C-O 118.712 -0.661 . . . . 0.0 110.42 176.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.2 tm? . . . . . 0 N--CA 1.488 1.452 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -172.59 129.49 0.54 Allowed 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.183 0.993 . . . . 0.0 109.509 177.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 177.8 67.25 0.06 OUTLIER Glycine 0 C--N 1.339 0.741 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -156.35 133.9 3.85 Favored Glycine 0 C--N 1.346 1.093 0 N-CA-C 112.04 -0.424 . . . . 0.0 112.04 -179.218 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -124.43 -62.27 1.27 Allowed 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.175 0.99 . . . . 0.0 110.096 -178.209 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.6 t -131.9 -61.23 0.89 Allowed 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.251 0.621 . . . . 0.0 109.738 -176.323 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 50.6 ttm -91.55 146.89 23.42 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 176.064 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -74.94 77.57 2.17 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-O 121.754 0.788 . . . . 0.0 110.329 177.396 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 49.2 t -77.58 -26.49 15.17 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-N 114.878 -1.056 . . . . 0.0 110.605 -177.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -67.06 -33.4 75.44 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.31 0.644 . . . . 0.0 110.759 178.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.8 m -61.94 -43.37 98.98 Favored 'General case' 0 C--O 1.243 0.732 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.378 172.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.449 ' HA ' HG22 ' A' ' 15' ' ' ILE . 22.6 m-85 -68.61 -37.97 80.19 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 114.941 -1.027 . . . . 0.0 110.585 177.414 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.488 ' HG2' HG21 ' A' ' 76' ' ' ILE . 2.5 tm-20 -56.47 -55.39 34.27 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 125.218 1.407 . . . . 0.0 110.302 -175.21 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.1 -45.03 78.46 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.79 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.457 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 12.5 tt -65.22 -31.63 54.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 CA-C-N 118.099 0.409 . . . . 0.0 110.847 -174.242 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.536 ' HB3' HG23 ' A' ' 69' ' ' ILE . 60.1 mt -64.57 -44.38 90.89 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.516 0.726 . . . . 0.0 110.449 174.577 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 53.1 mtt180 -63.44 -39.77 95.37 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 123.864 0.728 . . . . 0.0 111.357 177.347 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -65.93 -44.21 85.78 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.899 0.479 . . . . 0.0 110.473 -177.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.457 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -66.38 -43.58 85.5 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.893 178.276 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.65 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.0 pt20 -70.14 -29.41 66.32 Favored 'General case' 0 C--O 1.207 -1.171 0 CA-C-O 118.608 -0.711 . . . . 0.0 110.707 -177.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 87.5 mtt180 -74.93 -44.58 47.8 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.704 0.802 . . . . 0.0 112.114 -177.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -62.62 -43.37 98.99 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-O 121.371 0.605 . . . . 0.0 109.703 177.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.592 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 86.6 mt -70.59 -33.84 71.52 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 114.918 -1.037 . . . . 0.0 110.417 176.469 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.49 ' O ' ' HB2' ' A' ' 28' ' ' HIS . 0.2 OUTLIER -59.93 -56.62 19.42 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.285 0.634 . . . . 0.0 109.586 -177.917 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 20.4 ptt180 -64.62 -30.36 71.38 Favored 'General case' 0 N--CA 1.48 1.067 0 O-C-N 124.044 0.84 . . . . 0.0 110.895 -177.627 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -58.86 -57.75 11.68 Favored 'General case' 0 C--N 1.36 1.035 0 O-C-N 123.614 0.571 . . . . 0.0 111.359 175.193 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.618 ' HB2' ' HA ' ' A' ' 58' ' ' LEU . 2.2 pp -84.04 -25.32 29.96 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -174.508 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.49 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 3.5 m-70 -89.13 48.1 1.58 Allowed 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 123.845 0.858 . . . . 0.0 109.571 177.843 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.415 ' HA ' ' O ' ' A' ' 32' ' ' ALA . 9.7 ptpt -64.93 -23.75 67.32 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 125.01 1.324 . . . . 0.0 111.765 178.456 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.495 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -62.75 -36.32 74.84 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.096 0 C-N-CA 124.113 0.965 . . . . 0.0 112.246 178.402 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -101.67 -26.78 13.38 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.023 0.529 . . . . 0.0 110.514 178.425 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.415 ' O ' ' HA ' ' A' ' 29' ' ' LYS . . . -125.17 91.92 3.53 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.078 0.951 . . . . 0.0 110.298 -173.142 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -70.33 134.26 47.75 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 169.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -66.0 85.07 0.08 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.564 0.746 . . . . 0.0 110.326 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -101.15 -16.65 16.97 Favored 'General case' 0 C--O 1.241 0.652 0 C-N-CA 123.938 0.895 . . . . 0.0 110.215 179.233 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -73.99 138.27 76.12 Favored Pre-proline 0 CA--C 1.548 0.9 0 CA-C-N 115.309 -0.859 . . . . 0.0 109.586 178.326 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -61.2 160.55 26.21 Favored 'Trans proline' 0 C--N 1.378 2.12 0 C-N-CA 122.986 2.457 . . . . 0.0 112.484 175.138 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 15.3 mmm180 -72.61 -18.69 61.57 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.434 0.694 . . . . 0.0 111.252 175.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -69.66 153.22 95.83 Favored Pre-proline 0 CA--C 1.551 1.015 0 C-N-CA 123.495 0.718 . . . . 0.0 109.636 168.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -67.17 78.22 0.43 Allowed 'Trans proline' 0 C--N 1.377 2.033 0 C-N-CA 122.746 2.298 . . . . 0.0 111.874 175.615 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -110.28 35.62 3.36 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 124.324 1.049 . . . . 0.0 108.447 -177.613 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -75.37 80.07 2.44 Favored 'General case' 0 C--N 1.351 0.633 0 CA-C-N 114.61 -1.177 . . . . 0.0 109.148 178.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -82.44 -51.58 7.7 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-N 114.807 -1.088 . . . . 0.0 109.966 -178.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -164.34 123.43 1.9 Allowed 'General case' 0 C--O 1.239 0.537 0 CA-C-N 114.832 -1.076 . . . . 0.0 109.568 175.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 10.2 tpt180 -137.23 101.25 4.48 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 106.422 -1.695 . . . . 0.0 106.422 175.024 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.33 -31.25 63.56 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 124.37 1.068 . . . . 0.0 113.839 -166.133 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 78.3 p 48.04 36.92 6.94 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 125.156 1.382 . . . . 0.0 111.341 -172.298 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -68.75 -22.52 64.3 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 114.372 -1.285 . . . . 0.0 110.793 -176.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 52.6 mtp180 73.87 161.25 0.24 Allowed 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 125.581 1.553 . . . . 0.0 112.513 177.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 34.7 t -135.58 -112.25 0.2 Allowed 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 175.334 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -76.98 118.59 19.71 Favored 'General case' 0 C--N 1.354 0.765 0 CA-C-N 119.052 0.842 . . . . 0.0 109.249 171.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -125.25 86.69 2.58 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.584 0.707 . . . . 0.0 109.522 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -119.11 -170.39 1.91 Allowed 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.47 174.416 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 90.6 t -57.78 -59.33 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 123.443 0.697 . . . . 0.0 110.043 176.034 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.634 ' HB2' ' HG ' ' A' ' 58' ' ' LEU . 95.5 mt 58.31 124.51 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 125.793 1.637 . . . . 0.0 114.199 172.642 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -65.09 -20.18 66.35 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.334 0.654 . . . . 0.0 110.704 173.287 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -64.21 -30.36 71.42 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.022 1.329 . . . . 0.0 111.155 176.243 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.634 ' HG ' ' HB2' ' A' ' 55' ' ' LEU . 9.2 mt -81.3 141.46 34.04 Favored 'General case' 0 C--N 1.35 0.592 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 179.164 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -81.08 142.76 23.5 Favored Glycine 0 C--N 1.349 1.273 0 CA-C-O 119.292 -0.727 . . . . 0.0 112.039 177.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -55.41 -54.74 39.94 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 124.365 1.066 . . . . 0.0 112.014 -174.736 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.4 p -53.29 -41.24 42.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 123.701 0.8 . . . . 0.0 111.492 178.111 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.426 ' HA3' HD23 ' A' ' 27' ' ' LEU . . . -67.89 -41.64 87.68 Favored Glycine 0 C--O 1.215 -1.053 0 O-C-N 123.767 0.667 . . . . 0.0 113.049 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -66.75 -46.34 75.7 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.205 0.602 . . . . 0.0 111.01 -178.455 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -63.27 -37.3 86.69 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.837 0.855 . . . . 0.0 110.884 178.229 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -71.27 -45.03 64.1 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.141 -179.231 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.7 mp -62.27 -33.23 74.22 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.562 1.145 . . . . 0.0 110.932 176.849 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 73.3 ttt180 -67.95 -43.35 79.28 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.672 0.789 . . . . 0.0 110.339 176.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -67.62 -38.36 83.8 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.755 0.822 . . . . 0.0 111.273 179.277 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.65 HG21 ' HB3' ' A' ' 20' ' ' GLN . 96.6 mt -69.61 -41.67 80.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.858 0.863 . . . . 0.0 110.075 177.011 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -63.73 -38.56 91.55 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.673 0.789 . . . . 0.0 110.76 178.061 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.499 ' HB1' HH12 ' A' ' 75' ' ' ARG . . . -63.95 -42.91 97.17 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.867 0.867 . . . . 0.0 110.687 177.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.446 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -66.0 -51.32 59.41 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 114.913 -1.039 . . . . 0.0 111.102 179.1 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.522 HD23 HD12 ' A' ' 76' ' ' ILE . 82.1 mt -62.59 -36.72 83.61 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.427 1.091 . . . . 0.0 111.886 -179.214 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.81 -43.9 97.59 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.469 0.708 . . . . 0.0 110.244 175.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.499 HH12 ' HB1' ' A' ' 71' ' ' ALA . 80.7 mtt85 -73.51 -26.3 60.82 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 115.244 -0.889 . . . . 0.0 112.267 179.43 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.522 HD12 HD23 ' A' ' 73' ' ' LEU . 80.6 mt -69.76 -46.59 74.05 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 CA-C-N 118.473 0.579 . . . . 0.0 109.536 174.615 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.74 -36.59 83.52 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.867 178.02 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 30.2 t -81.09 -17.77 48.86 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 123.729 0.812 . . . . 0.0 111.433 177.397 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 81.6 10.3 84.55 Favored Glycine 0 C--N 1.35 1.35 0 C-N-CA 123.198 0.428 . . . . 0.0 113.893 178.556 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.8 t -106.89 21.33 17.7 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 124.415 1.086 . . . . 0.0 110.261 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -61.46 142.79 56.76 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 122.578 0.351 . . . . 0.0 110.335 173.065 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.516 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 82.5 20.72 61.49 Favored Glycine 0 C--O 1.218 -0.864 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.521 -175.234 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 26.4 m -113.11 110.43 20.43 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 117.524 0.662 . . . . 0.0 109.825 174.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.446 ' HB2' HD13 ' A' ' 91' ' ' ILE . 49.2 t -73.45 93.91 2.03 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 124.459 1.104 . . . . 0.0 109.857 172.239 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 34.1 m -63.85 -22.25 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.298 1.039 . . . . 0.0 112.751 -176.676 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.534 ' HD3' ' HB3' ' A' ' 108' ' ' CYS . 56.4 tttm -69.83 -24.44 63.46 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 122.675 0.39 . . . . 0.0 111.585 -178.288 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 29.0 p -127.59 11.16 6.74 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 122.626 0.37 . . . . 0.0 110.879 173.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 56.63 27.11 54.38 Favored Glycine 0 C--N 1.36 1.9 0 C-N-CA 123.869 0.747 . . . . 0.0 114.932 176.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -135.96 -176.7 4.39 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.983 0.913 . . . . 0.0 110.228 -174.516 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.516 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 12.8 tpp180 -68.77 152.29 45.52 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 124.585 1.154 . . . . 0.0 112.664 -172.041 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.446 HD13 ' HB2' ' A' ' 84' ' ' CYS . 3.1 mm -92.16 145.36 7.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 165.302 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 61.8 m -66.99 145.25 55.6 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 122.252 0.221 . . . . 0.0 110.561 176.043 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -61.47 -39.94 92.72 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.254 0.622 . . . . 0.0 110.42 177.444 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.436 ' HA ' ' HG2' ' A' ' 97' ' ' LYS . 16.1 m-20 -65.2 -35.69 81.84 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.863 0.865 . . . . 0.0 111.303 178.266 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -63.87 -44.12 94.03 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.07 176.133 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 96.3 mt -75.45 -36.49 60.7 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.364 0.666 . . . . 0.0 112.502 -176.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.436 ' HG2' ' HA ' ' A' ' 94' ' ' ASP . 16.6 ptpt -73.25 -28.81 62.35 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 120.528 0.204 . . . . 0.0 110.713 -176.403 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -80.48 -48.66 12.49 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 123.923 0.765 . . . . 0.0 110.299 174.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.1 p -144.72 99.96 4.72 Favored Pre-proline 0 CA--C 1.555 1.161 0 C-N-CA 124.231 1.012 . . . . 0.0 109.299 -178.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -78.47 -5.57 14.97 Favored 'Trans proline' 0 C--N 1.373 1.836 0 C-N-CA 122.531 2.154 . . . . 0.0 113.021 178.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 18.9 p90 -105.34 54.37 0.7 Allowed 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.718 0.807 . . . . 0.0 110.032 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.8 t -135.14 101.57 11.24 Favored Pre-proline 0 CA--C 1.554 1.099 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.639 172.295 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -59.8 -18.79 50.91 Favored 'Trans proline' 0 C--N 1.382 2.295 0 C-N-CA 123.245 2.63 . . . . 0.0 113.096 172.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -104.48 126.09 51.25 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.841 0.857 . . . . 0.0 109.859 -177.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 16.5 p -69.39 158.88 34.25 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 171.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 62.9 tp60 -48.13 -39.84 21.78 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 114.09 1.144 . . . . 0.0 114.09 -169.633 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -69.37 -34.0 73.92 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-N 117.943 0.338 . . . . 0.0 111.849 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.534 ' HB3' ' HD3' ' A' ' 86' ' ' LYS . 99.5 m -72.33 -38.85 68.55 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.331 0.652 . . . . 0.0 111.396 174.19 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.58 -33.25 75.47 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.826 0.85 . . . . 0.0 111.017 176.03 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.99 -31.38 58.95 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.016 0.926 . . . . 0.0 111.047 176.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -80.2 -10.64 59.77 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.726 0.81 . . . . 0.0 112.276 -178.335 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 95.4 mt . . . . . 0 C--O 1.252 1.201 0 CA-C-O 118.693 -0.67 . . . . 0.0 110.227 177.181 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.4 mp . . . . . 0 N--CA 1.481 1.118 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 62.07 98.41 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 124.695 1.198 . . . . 0.0 110.682 -178.636 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -67.92 81.68 0.18 Allowed Glycine 0 C--N 1.351 1.38 0 CA-C-N 116.303 -0.408 . . . . 0.0 112.121 177.817 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -78.46 73.75 2.18 Favored Glycine 0 C--N 1.35 1.349 0 C-N-CA 123.377 0.513 . . . . 0.0 112.669 -177.05 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -67.69 -34.23 76.49 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.63 0.772 . . . . 0.0 110.349 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 32.1 t -62.99 -53.11 59.04 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.625 1.17 . . . . 0.0 110.985 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 39.0 ttp -85.63 4.44 36.36 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.294 0.637 . . . . 0.0 110.965 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.0 m120 63.18 28.1 15.81 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 124.631 1.172 . . . . 0.0 111.817 173.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 86.2 t -50.98 -41.21 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.607 1.163 . . . . 0.0 112.106 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -64.21 -37.4 87.35 Favored 'General case' 0 N--CA 1.484 1.27 0 O-C-N 123.722 0.639 . . . . 0.0 111.499 -176.783 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 17.4 m -63.0 -42.5 99.86 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.556 0.742 . . . . 0.0 110.042 176.474 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.522 ' HA ' HG22 ' A' ' 15' ' ' ILE . 28.3 m-85 -72.25 -33.79 67.77 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-N 114.611 -1.177 . . . . 0.0 110.735 179.131 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -59.73 -52.53 65.11 Favored 'General case' 0 C--O 1.246 0.875 0 C-N-CA 125.082 1.353 . . . . 0.0 110.268 -175.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.05 -48.49 68.14 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.995 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.522 HG22 ' HA ' ' A' ' 12' ' ' TYR . 13.3 tt -64.66 -29.65 48.0 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.35 0 CA-C-N 118.197 0.453 . . . . 0.0 110.688 -173.031 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.511 ' HB3' HG23 ' A' ' 69' ' ' ILE . 45.5 mt -62.34 -50.53 71.23 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.205 0.602 . . . . 0.0 110.248 172.27 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 52.3 mtm180 -64.23 -28.52 69.79 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.488 -0.778 . . . . 0.0 112.441 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -80.98 -33.34 33.85 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.302 0.641 . . . . 0.0 110.351 -177.302 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.449 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -69.46 -42.6 74.67 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.021 172.698 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.656 ' HB3' HG21 ' A' ' 69' ' ' ILE . 1.4 pt20 -71.37 -22.59 61.87 Favored 'General case' 0 C--O 1.208 -1.083 0 CA-C-O 119.349 -0.358 . . . . 0.0 110.324 179.554 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 32.6 mtt180 -62.84 -60.01 4.07 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.188 0.595 . . . . 0.0 110.52 173.218 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -60.98 -34.22 74.44 Favored 'General case' 0 N--CA 1.48 1.051 0 O-C-N 123.933 0.771 . . . . 0.0 110.833 -178.1 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 86.5 mt -69.08 -51.87 34.22 Favored 'General case' 0 C--N 1.352 0.707 0 C-N-CA 122.984 0.514 . . . . 0.0 111.336 176.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -56.19 -39.6 72.66 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 123.552 0.741 . . . . 0.0 111.416 -173.017 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 18.1 ptt180 -78.02 -33.36 51.16 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 122.428 0.291 . . . . 0.0 111.2 178.185 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 25.2 ttm180 -65.1 -41.42 94.95 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.517 0.727 . . . . 0.0 111.361 177.332 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.465 HD21 HD22 ' A' ' 66' ' ' LEU . 4.3 pp -94.02 -28.58 15.68 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.799 0.44 . . . . 0.0 111.193 -172.786 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -91.35 33.4 0.99 Allowed 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 167.591 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 18.8 pttp -46.59 -42.73 16.47 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 125.933 1.693 . . . . 0.0 112.465 169.42 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.511 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -62.48 -31.09 50.73 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.911 0 C-N-CA 124.34 1.056 . . . . 0.0 111.942 179.621 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -93.8 -21.04 19.54 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.653 0.781 . . . . 0.0 110.822 178.495 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -83.45 170.18 14.74 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.737 0.815 . . . . 0.0 110.493 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -84.43 30.53 0.54 Allowed 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 124.013 0.925 . . . . 0.0 111.862 -176.46 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 14.9 t80 60.44 95.91 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 124.895 1.278 . . . . 0.0 109.807 -174.481 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -61.18 -66.44 0.53 Allowed 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.467 0.707 . . . . 0.0 112.269 -168.03 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 60.92 108.5 0.03 OUTLIER Pre-proline 0 N--CA 1.483 1.186 0 C-N-CA 125.003 1.321 . . . . 0.0 110.921 -168.571 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -72.41 79.48 1.8 Allowed 'Trans proline' 0 C--N 1.377 2.035 0 C-N-CA 122.544 2.163 . . . . 0.0 111.304 179.427 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 25.3 mtp180 -63.36 -36.67 84.47 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.974 0.91 . . . . 0.0 110.06 179.4 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -143.83 138.58 15.29 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 124.915 1.286 . . . . 0.0 108.868 177.474 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -64.9 -24.87 60.38 Favored 'Trans proline' 0 C--N 1.38 2.219 0 C-N-CA 122.666 2.244 . . . . 0.0 111.586 174.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -86.58 133.81 33.69 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.348 1.059 . . . . 0.0 110.081 177.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.52 172.67 12.99 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.377 0.671 . . . . 0.0 110.792 171.744 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -90.12 75.17 7.09 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 173.434 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 26.8 t70 68.55 29.81 5.41 Favored 'General case' 0 CA--C 1.557 1.228 0 CA-C-N 114.23 -1.35 . . . . 0.0 110.269 178.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 35.6 ttp180 69.61 126.92 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 125.339 1.456 . . . . 0.0 111.605 -176.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -145.88 -176.43 5.14 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.085 0.554 . . . . 0.0 111.257 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 40.9 m 78.21 149.67 0.1 Allowed 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 126.279 1.831 . . . . 0.0 112.858 175.432 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.533 ' HG3' ' HD2' ' A' ' 49' ' ' ARG . 13.0 pt-20 -158.47 -131.2 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.051 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 173.414 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.533 ' HD2' ' HG3' ' A' ' 48' ' ' GLU . 8.3 mpt_? 66.29 80.48 0.22 Allowed 'General case' 0 C--N 1.361 1.084 0 C-N-CA 124.173 0.989 . . . . 0.0 110.057 179.003 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.6 p -83.75 70.83 10.42 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 114.848 -1.069 . . . . 0.0 109.931 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.546 ' HB3' ' HG2' ' A' ' 53' ' ' GLU . 2.1 m-20 -69.29 124.11 22.96 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 114.987 -1.006 . . . . 0.0 109.849 -178.804 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -107.45 38.6 2.1 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.607 0.763 . . . . 0.0 109.754 178.278 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.546 ' HG2' ' HB3' ' A' ' 51' ' ' ASN . 12.5 mm-40 -65.82 150.49 48.48 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.266 -0.879 . . . . 0.0 112.089 -175.435 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 38.6 t -67.51 -26.44 35.62 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 C-N-CA 124.218 1.007 . . . . 0.0 110.594 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 32.1 tp -58.75 111.67 1.36 Allowed 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 123.407 0.683 . . . . 0.0 110.77 178.257 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -98.34 48.39 0.99 Allowed 'General case' 0 CA--C 1.554 1.103 0 CA-C-O 122.452 1.12 . . . . 0.0 109.121 -175.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -93.3 26.03 3.1 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 124.964 1.306 . . . . 0.0 109.871 173.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.409 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 7.8 mt -103.26 147.26 27.27 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.18 0.992 . . . . 0.0 109.035 -170.699 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -64.65 145.01 49.11 Favored Glycine 0 N--CA 1.477 1.387 0 CA-C-O 119.592 -0.56 . . . . 0.0 113.27 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -64.07 -60.35 3.34 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.699 0.8 . . . . 0.0 111.719 -174.536 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.2 t -58.89 -32.34 47.03 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 123.881 0.872 . . . . 0.0 110.2 177.119 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.514 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -59.66 -51.77 57.02 Favored Glycine 0 C--N 1.353 1.511 0 O-C-N 124.051 0.844 . . . . 0.0 112.624 174.743 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -72.27 -36.66 69.07 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 124.098 0.959 . . . . 0.0 112.339 -175.22 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -73.28 -38.77 65.79 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.413 0.685 . . . . 0.0 110.369 -176.647 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -71.22 -37.05 72.05 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.627 174.186 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' A' ' 62' ' ' GLY . 6.2 tp -58.62 -45.95 88.13 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 124.606 1.162 . . . . 0.0 109.568 177.209 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 47.4 ttt180 -64.84 -38.84 92.31 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.481 1.112 . . . . 0.0 110.5 -178.049 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.52 -36.64 83.2 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.914 177.015 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.656 HG21 ' HB3' ' A' ' 20' ' ' GLN . 95.0 mt -69.86 -49.79 54.24 Favored 'Isoleucine or valine' 0 C--N 1.356 0.86 0 C-N-CA 123.594 0.758 . . . . 0.0 110.83 178.59 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 52.6 m-20 -65.18 -35.64 81.71 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.753 0.821 . . . . 0.0 111.151 -177.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.432 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -64.88 -45.5 85.73 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.312 0.645 . . . . 0.0 109.96 175.028 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.412 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -67.15 -34.91 78.58 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.993 0.917 . . . . 0.0 111.709 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.47 HD23 HD12 ' A' ' 76' ' ' ILE . 71.9 mt -72.75 -32.33 65.59 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.857 0.863 . . . . 0.0 110.821 177.099 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.57 -27.64 63.29 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.875 0.87 . . . . 0.0 110.785 174.471 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.432 ' HG2' ' O ' ' A' ' 71' ' ' ALA . 5.7 mmp_? -69.06 -42.48 76.2 Favored 'General case' 0 C--N 1.353 0.75 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 172.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.47 HD12 HD23 ' A' ' 73' ' ' LEU . 71.1 mt -64.68 -41.36 92.0 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 C-N-CA 123.206 0.602 . . . . 0.0 110.367 177.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -59.37 -38.81 81.39 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.027 0.931 . . . . 0.0 111.292 178.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.535 ' HB3' HG22 ' A' ' 80' ' ' THR . 35.5 t -87.05 -13.9 43.04 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 115.027 -0.988 . . . . 0.0 111.226 178.279 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 78.75 8.15 87.88 Favored Glycine 0 C--N 1.348 1.25 0 C-N-CA 123.177 0.417 . . . . 0.0 113.441 -176.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.535 HG22 ' HB3' ' A' ' 78' ' ' SER . 13.5 t -101.4 24.58 9.41 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.708 1.203 . . . . 0.0 110.065 -178.476 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -61.89 152.87 30.66 Favored 'General case' 0 C--N 1.35 0.595 0 C-N-CA 123.222 0.609 . . . . 0.0 110.351 170.398 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.53 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 70.39 21.39 77.42 Favored Glycine 0 C--N 1.344 0.984 0 CA-C-N 115.639 -0.71 . . . . 0.0 112.476 -176.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 30.9 m -118.23 113.89 22.19 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.471 0.709 . . . . 0.0 109.69 178.154 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 52.7 t -72.93 90.12 1.45 Allowed 'General case' 0 C--O 1.238 0.472 0 C-N-CA 123.438 0.695 . . . . 0.0 109.517 171.633 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 29.5 m -61.22 -23.03 28.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 124.411 1.084 . . . . 0.0 112.756 -176.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.401 ' HD3' ' HB3' ' A' ' 108' ' ' CYS . 54.5 tttm -64.71 -27.2 68.75 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.305 0.642 . . . . 0.0 111.588 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.442 ' SG ' ' HB2' ' A' ' 89' ' ' LYS . 30.7 p -136.14 4.12 2.94 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 112.038 0.384 . . . . 0.0 112.038 -179.252 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 63.06 30.89 78.87 Favored Glycine 0 C--N 1.349 1.264 0 O-C-N 123.128 0.267 . . . . 0.0 113.723 -178.697 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.442 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 11.5 mmmm -106.88 172.08 7.01 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.806 0.842 . . . . 0.0 110.462 -179.568 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.53 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 15.2 tpp180 -90.92 128.4 36.76 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.126 0.97 . . . . 0.0 109.651 177.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 9.2 mm -64.91 142.4 16.97 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 171.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 19.6 m -74.26 150.72 40.11 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 122.847 0.459 . . . . 0.0 109.774 177.382 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -61.96 -37.14 83.64 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 122.919 0.488 . . . . 0.0 110.287 175.293 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -62.17 -45.87 91.46 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 124.115 0.966 . . . . 0.0 110.755 176.243 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.442 ' HG3' HG21 ' A' ' 102' ' ' THR . 28.3 tpt180 -60.85 -40.62 93.57 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.405 175.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 82.0 mt -69.75 -38.45 76.81 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.508 0.723 . . . . 0.0 112.184 -178.597 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -79.18 -30.95 43.69 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 122.372 0.269 . . . . 0.0 110.42 -174.431 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -80.06 -39.28 30.08 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.806 0.842 . . . . 0.0 110.641 177.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.5 p -148.48 92.3 4.54 Favored Pre-proline 0 CA--C 1.556 1.196 0 C-N-CA 124.33 1.052 . . . . 0.0 109.49 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.06 -17.3 31.82 Favored 'Trans proline' 0 C--N 1.378 2.086 0 C-N-CA 122.404 2.069 . . . . 0.0 112.346 175.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 10.7 p90 -94.6 62.71 2.82 Favored 'General case' 0 C--N 1.348 0.525 0 C-N-CA 124.333 1.053 . . . . 0.0 109.092 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.442 HG21 ' HG3' ' A' ' 95' ' ' ARG . 12.4 t -137.54 117.08 10.19 Favored Pre-proline 0 CA--C 1.553 1.089 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.511 178.73 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -81.23 -7.29 12.98 Favored 'Trans proline' 0 C--N 1.368 1.568 0 C-N-CA 122.259 1.972 . . . . 0.0 111.877 169.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -116.97 143.97 45.11 Favored 'General case' 0 C--N 1.356 0.858 0 C-N-CA 123.465 0.706 . . . . 0.0 110.162 -175.166 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 30.6 p -80.89 164.25 22.77 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 174.697 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -51.31 -37.77 49.34 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.791 0.837 . . . . 0.0 111.705 -178.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -54.88 -53.59 53.48 Favored 'General case' 0 CA--C 1.55 0.957 0 O-C-N 124.378 1.049 . . . . 0.0 110.74 175.533 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.401 ' HB3' ' HD3' ' A' ' 86' ' ' LYS . 87.8 m -71.35 -34.24 70.33 Favored 'General case' 0 N--CA 1.482 1.141 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.68 -176.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -63.28 -38.85 92.75 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.718 0.807 . . . . 0.0 110.546 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -77.34 -25.94 51.57 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.802 0.841 . . . . 0.0 111.108 176.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -106.17 22.81 15.09 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 123.898 0.879 . . . . 0.0 111.976 -176.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 73.0 mt . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 119.028 -0.511 . . . . 0.0 110.004 173.04 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 4.5 mp . . . . . 0 N--CA 1.493 1.68 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 57.43 86.78 0.07 Allowed 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.86 1.264 . . . . 0.0 112.949 171.306 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -67.73 -44.99 78.93 Favored Glycine 0 C--N 1.347 1.15 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.763 179.329 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -107.3 85.99 0.44 Allowed Glycine 0 C--N 1.338 0.664 0 N-CA-C 111.344 -0.702 . . . . 0.0 111.344 178.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -156.49 -71.65 0.1 Allowed 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.286 0.634 . . . . 0.0 110.956 178.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.636 ' HB2' ' HB2' ' A' ' 93' ' ' GLU . 59.6 p -100.98 62.67 0.99 Allowed 'General case' 0 C--O 1.245 0.86 0 C-N-CA 123.743 0.817 . . . . 0.0 110.963 -171.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 39.1 ttm -167.68 96.16 0.45 Allowed 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.188 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -89.32 84.09 6.45 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 171.023 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 90.6 t -54.92 -41.81 60.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 CA-C-N 114.675 -1.148 . . . . 0.0 111.966 -172.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -61.07 -39.22 89.07 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.708 0.803 . . . . 0.0 111.732 -177.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 17.7 m -62.5 -42.2 99.34 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.379 0.672 . . . . 0.0 110.013 177.119 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.475 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 26.4 m-85 -71.6 -33.02 68.64 Favored 'General case' 0 C--O 1.213 -0.844 0 CA-C-N 114.558 -1.201 . . . . 0.0 110.788 179.066 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -67.42 -53.13 31.75 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 124.047 0.939 . . . . 0.0 110.523 -175.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -63.13 -43.32 98.69 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.416 -179.171 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.495 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 13.7 tt -65.24 -33.4 63.42 Favored 'Isoleucine or valine' 0 C--N 1.363 1.16 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 -177.072 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.531 ' HB3' HG23 ' A' ' 69' ' ' ILE . 61.2 mt -67.17 -36.82 82.61 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.127 0.571 . . . . 0.0 111.402 177.653 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 19.8 mtm180 -63.79 -41.49 97.92 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 123.279 0.362 . . . . 0.0 110.856 176.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -69.78 -40.25 76.15 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.028 0.531 . . . . 0.0 111.468 -179.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.495 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -63.99 -50.34 68.92 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.442 0.697 . . . . 0.0 110.276 178.621 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.614 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.9 pt20 -64.71 -31.56 72.83 Favored 'General case' 0 C--O 1.213 -0.864 0 CA-C-O 119.248 -0.406 . . . . 0.0 110.494 -178.706 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 29.6 mtt85 -68.68 -51.03 46.2 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.43 0.692 . . . . 0.0 112.129 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -61.37 -35.1 76.53 Favored 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 178.568 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.535 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 95.6 mt -67.0 -45.47 77.51 Favored 'General case' 0 C--O 1.215 -0.75 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.674 173.836 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.483 ' HB3' ' HG3' ' A' ' 48' ' ' GLU . 1.8 m-85 -60.62 -47.24 87.1 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.883 0.873 . . . . 0.0 111.954 -173.306 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.448 ' HD3' ' HG2' ' A' ' 35' ' ' GLU . 9.0 ptp180 -66.72 -35.43 80.11 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 122.637 0.375 . . . . 0.0 110.273 176.506 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.426 ' O ' ' HE3' ' A' ' 29' ' ' LYS . 37.1 ttm180 -63.5 -43.63 96.69 Favored 'General case' 0 C--N 1.362 1.11 0 C-N-CA 123.709 0.804 . . . . 0.0 112.031 178.639 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 2.7 pp -86.09 -21.23 27.76 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 122.977 0.511 . . . . 0.0 111.319 -176.862 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 57.6 m-70 -90.3 26.64 1.87 Allowed 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 171.189 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.426 ' HE3' ' O ' ' A' ' 26' ' ' ARG . 9.7 ptpp? -48.35 -30.14 4.64 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 126.21 1.804 . . . . 0.0 113.942 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.47 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -62.39 -26.4 40.3 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 124.38 1.072 . . . . 0.0 112.344 -177.689 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -122.38 -35.96 3.03 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.639 0.776 . . . . 0.0 111.087 -178.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -79.75 94.19 5.71 Favored 'General case' 0 C--N 1.348 0.505 0 C-N-CA 123.897 0.879 . . . . 0.0 109.555 -177.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -121.75 -39.09 2.66 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.734 1.214 . . . . 0.0 108.335 176.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -105.66 77.08 1.24 Allowed 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.657 178.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.448 ' HG2' ' HD3' ' A' ' 25' ' ' ARG . 5.9 mp0 -70.62 -65.02 0.79 Allowed 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 106.861 -1.533 . . . . 0.0 106.861 167.779 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -117.72 154.99 51.13 Favored Pre-proline 0 CA--C 1.539 0.554 0 CA-C-N 114.448 -1.251 . . . . 0.0 109.008 178.332 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -52.67 -61.81 0.44 Allowed 'Trans proline' 0 C--N 1.38 2.201 0 C-N-CA 122.947 2.431 . . . . 0.0 112.518 175.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.2 ptt180 -168.15 58.28 0.06 Allowed 'General case' 0 N--CA 1.48 1.027 0 CA-C-O 122.269 1.033 . . . . 0.0 109.232 174.562 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -91.37 143.21 27.87 Favored Pre-proline 0 N--CA 1.478 0.928 0 CA-C-N 114.876 -1.056 . . . . 0.0 111.268 -175.462 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -61.84 137.7 69.53 Favored 'Trans proline' 0 C--N 1.38 2.209 0 C-N-CA 122.858 2.372 . . . . 0.0 110.994 171.197 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -56.82 100.76 0.05 OUTLIER 'General case' 0 N--CA 1.485 1.281 0 O-C-N 123.978 0.799 . . . . 0.0 110.043 175.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -148.58 -69.75 0.22 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.486 0.714 . . . . 0.0 109.467 -170.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -93.22 -58.24 2.37 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 49.8 50.5 18.27 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 125.26 1.424 . . . . 0.0 110.157 178.322 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -59.22 -62.33 1.96 Allowed 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.487 -172.509 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 62.4 -177.73 0.13 Allowed 'General case' 0 N--CA 1.477 0.891 0 O-C-N 124.524 1.14 . . . . 0.0 112.624 -177.375 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 28.1 t -158.47 35.74 0.23 Allowed 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 177.637 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.483 ' HG3' ' HB3' ' A' ' 24' ' ' TYR . 0.7 OUTLIER -61.62 150.1 37.32 Favored 'General case' 0 C--N 1.353 0.725 0 CA-C-N 114.695 -1.139 . . . . 0.0 111.996 -173.375 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -66.52 89.62 0.15 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 124.54 1.136 . . . . 0.0 110.971 -178.369 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 37.1 p -78.91 135.78 37.08 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.714 176.389 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 59.28 82.43 0.15 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.855 1.262 . . . . 0.0 110.081 -175.669 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -144.99 87.46 1.83 Allowed 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 114.855 -1.066 . . . . 0.0 108.153 -174.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 59.79 177.71 0.09 Allowed 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 125.124 1.37 . . . . 0.0 113.13 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 95.2 t -77.22 -59.98 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 174.669 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 32.6 tp 53.63 109.77 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 125.771 1.628 . . . . 0.0 112.816 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -62.09 -24.6 67.22 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 123.183 0.593 . . . . 0.0 111.773 178.48 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -74.85 1.71 11.98 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.509 0.724 . . . . 0.0 112.442 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.487 HD13 HD13 ' A' ' 27' ' ' LEU . 19.1 mt -76.11 -63.67 1.27 Allowed 'General case' 0 C--N 1.354 0.785 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 171.738 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 119.82 146.1 7.66 Favored Glycine 0 N--CA 1.475 1.278 0 CA-C-O 119.253 -0.749 . . . . 0.0 111.651 177.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 60.3 tt0 -58.08 -50.9 71.84 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.047 0.939 . . . . 0.0 111.892 -173.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 7.1 p -54.74 -38.79 44.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 123.71 0.804 . . . . 0.0 111.402 179.787 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -71.3 -53.5 10.3 Favored Glycine 0 C--N 1.346 1.124 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.797 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -65.46 -38.11 88.86 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 124.249 1.02 . . . . 0.0 111.534 -175.065 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -69.13 -43.29 74.68 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.889 0.876 . . . . 0.0 110.252 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -70.41 -35.64 73.55 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.577 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.3 mp -63.15 -39.59 95.1 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.215 1.006 . . . . 0.0 110.792 175.518 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 52.6 ttt180 -59.89 -45.7 91.7 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.932 0.893 . . . . 0.0 110.026 175.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.519 ' HB1' ' O ' ' A' ' 101' ' ' TYR . . . -64.87 -44.79 88.53 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 114.713 -1.131 . . . . 0.0 111.922 -178.272 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.614 HG21 ' HB3' ' A' ' 20' ' ' GLN . 83.3 mt -70.74 -44.64 76.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 123.581 0.752 . . . . 0.0 110.81 -178.623 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -68.2 -37.48 80.95 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.365 0.666 . . . . 0.0 110.835 -175.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.464 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -64.93 -43.08 93.95 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.795 0.684 . . . . 0.0 110.232 176.767 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.43 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -62.09 -45.5 93.22 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 123.884 0.74 . . . . 0.0 110.996 177.649 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.541 HD23 HD12 ' A' ' 76' ' ' ILE . 86.2 mt -63.31 -34.92 78.73 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 124.263 1.025 . . . . 0.0 111.589 176.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.44 -35.92 81.51 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.464 0.706 . . . . 0.0 110.711 177.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.464 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 52.6 mtp85 -72.77 -29.09 63.01 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.987 176.511 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.541 HD12 HD23 ' A' ' 73' ' ' LEU . 84.0 mt -66.99 -44.08 88.68 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 122.574 0.35 . . . . 0.0 110.084 176.252 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.1 -35.23 80.48 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.521 0.729 . . . . 0.0 111.119 177.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.417 ' HB3' HG22 ' A' ' 80' ' ' THR . 32.4 t -79.64 -19.8 48.28 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 123.604 0.762 . . . . 0.0 111.358 177.535 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 80.58 12.1 83.31 Favored Glycine 0 C--N 1.351 1.365 0 C-N-CA 123.034 0.349 . . . . 0.0 113.6 -178.551 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.417 HG22 ' HB3' ' A' ' 78' ' ' SER . 10.2 t -110.28 21.54 16.59 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 124.279 1.032 . . . . 0.0 110.781 179.558 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 75.6 t80 -60.14 145.26 47.51 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.118 0.567 . . . . 0.0 111.595 171.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 75.11 38.53 39.83 Favored Glycine 0 C--N 1.348 1.247 0 O-C-N 124.016 0.823 . . . . 0.0 111.926 -176.584 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 40.5 m -127.78 117.9 22.73 Favored 'General case' 0 C--O 1.243 0.731 0 C-N-CA 124.014 0.926 . . . . 0.0 109.16 175.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 51.2 t -61.49 102.7 0.26 Allowed 'General case' 0 C--N 1.351 0.649 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 169.133 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 23.1 m -56.69 -38.42 57.73 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 C-N-CA 124.312 1.045 . . . . 0.0 111.562 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -68.77 -21.65 64.34 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.07 0.948 . . . . 0.0 111.361 -177.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 59.9 m -105.24 -29.65 10.18 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.398 0.679 . . . . 0.0 111.962 178.299 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 66.34 32.08 80.89 Favored Glycine 0 CA--C 1.536 1.35 0 N-CA-C 111.624 -0.59 . . . . 0.0 111.624 -161.009 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -130.73 -178.44 4.8 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.971 0.909 . . . . 0.0 110.999 -174.262 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 25.8 mmm180 -71.99 159.95 33.35 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.832 0.853 . . . . 0.0 113.17 -175.21 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 39.2 mm -106.93 147.0 12.62 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 CA-C-N 114.521 -1.218 . . . . 0.0 108.196 163.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 13.2 m -73.97 149.78 41.14 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.418 0.687 . . . . 0.0 110.252 178.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.636 ' HB2' ' HB2' ' A' ' 6' ' ' SER . 32.2 tt0 -58.8 -45.16 90.56 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.48 0.712 . . . . 0.0 110.23 175.418 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.403 ' HA ' ' HE3' ' A' ' 97' ' ' LYS . 38.0 m-20 -65.32 -31.87 73.23 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.457 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.535 ' HE ' ' HA ' ' A' ' 95' ' ' ARG . 2.1 tpm_? -70.79 -40.75 72.37 Favored 'General case' 0 C--O 1.216 -0.687 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.095 175.278 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 79.5 mt -70.63 -39.53 73.63 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.377 0.671 . . . . 0.0 111.723 -178.138 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.403 ' HE3' ' HA ' ' A' ' 94' ' ' ASP . 16.0 ptpt -71.81 -31.88 67.01 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 122.684 0.394 . . . . 0.0 110.312 -176.596 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -77.17 -58.24 3.39 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.073 0.549 . . . . 0.0 110.386 174.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.6 p -130.98 95.2 26.06 Favored Pre-proline 0 CA--C 1.562 1.427 0 C-N-CA 124.81 1.244 . . . . 0.0 109.857 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -80.14 -11.66 13.37 Favored 'Trans proline' 0 C--N 1.378 2.106 0 C-N-CA 122.71 2.273 . . . . 0.0 112.929 177.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' TYR . . . . . 0.519 ' O ' ' HB1' ' A' ' 68' ' ' ALA . 10.2 p90 -95.74 36.29 1.3 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.329 0.651 . . . . 0.0 111.069 179.678 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 15.0 t -106.78 120.26 48.79 Favored Pre-proline 0 CA--C 1.555 1.159 0 O-C-N 122.088 -0.382 . . . . 0.0 110.506 177.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -78.41 -9.37 16.22 Favored 'Trans proline' 0 C--N 1.376 2.013 0 C-N-CA 122.361 2.04 . . . . 0.0 112.097 168.619 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.437 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 14.9 m-85 -118.13 159.04 23.96 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.043 0.537 . . . . 0.0 110.465 -174.886 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 31.1 p -85.81 169.5 13.3 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 174.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.495 ' HB2' ' HD2' ' A' ' 95' ' ' ARG . 36.1 tt0 -59.32 -28.39 66.77 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 122.985 0.514 . . . . 0.0 111.439 -176.687 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -70.04 -47.17 63.14 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.319 1.048 . . . . 0.0 109.851 -178.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.437 ' HB2' ' HB3' ' A' ' 104' ' ' PHE . 94.0 m -68.44 -36.08 78.52 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.1 175.37 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -62.8 -36.58 83.61 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.161 0.985 . . . . 0.0 111.058 178.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.29 -33.74 70.01 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.575 174.204 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -80.23 -10.07 59.75 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 123.67 0.788 . . . . 0.0 112.84 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 82.2 mt . . . . . 0 C--O 1.254 1.339 0 C-N-CA 123.089 0.556 . . . . 0.0 110.984 -179.147 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 55.6 tp . . . . . 0 N--CA 1.473 0.688 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 68.01 -71.97 0.1 Allowed 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 125.472 1.509 . . . . 0.0 111.408 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.426 ' HA2' ' HB2' ' A' ' 10' ' ' GLU . . . 72.1 -77.88 0.68 Allowed Glycine 0 C--N 1.357 1.698 0 C-N-CA 123.433 0.539 . . . . 0.0 113.177 175.028 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -132.64 63.4 0.62 Allowed Glycine 0 C--N 1.34 0.783 0 N-CA-C 110.272 -1.131 . . . . 0.0 110.272 175.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.2 ttpp -74.52 -60.8 2.11 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-O 121.42 0.628 . . . . 0.0 110.66 -174.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 30.4 t -142.64 14.26 1.95 Allowed 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.987 0.915 . . . . 0.0 109.442 176.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' MET . . . . . 0.443 ' HB3' ' HE2' ' A' ' 7' ' ' MET . 22.1 ptp -175.51 173.12 2.51 Favored 'General case' 0 C--O 1.241 0.637 0 C-N-CA 125.767 1.627 . . . . 0.0 107.582 -175.68 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -79.68 70.86 6.26 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 176.236 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 22.8 t -63.33 -37.68 80.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.959 -173.114 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.426 ' HB2' ' HA2' ' A' ' 3' ' ' GLY . 42.4 tt0 -58.47 -41.16 84.62 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 124.192 0.933 . . . . 0.0 110.845 -178.592 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.3 m -58.54 -47.24 84.87 Favored 'General case' 0 C--N 1.351 0.654 0 O-C-N 124.097 0.873 . . . . 0.0 110.611 176.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.413 ' HA ' HG22 ' A' ' 15' ' ' ILE . 51.8 m-85 -67.87 -37.72 82.16 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 124.335 1.022 . . . . 0.0 111.361 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.456 ' O ' ' HG3' ' A' ' 17' ' ' ARG . 2.4 tm-20 -60.97 -56.49 20.45 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.29 1.036 . . . . 0.0 110.145 -176.177 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -72.13 -35.65 69.18 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.048 -175.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.445 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 11.4 tt -66.72 -33.9 66.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 CA-C-N 118.368 0.531 . . . . 0.0 110.128 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.481 ' HB3' HG23 ' A' ' 69' ' ' ILE . 64.0 mt -67.48 -38.32 84.2 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 122.964 0.506 . . . . 0.0 110.557 174.668 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.5 ' O ' ' HG2' ' A' ' 21' ' ' ARG . 15.5 mtm180 -64.79 -46.05 83.67 Favored 'General case' 0 C--N 1.353 0.732 0 O-C-N 123.314 0.384 . . . . 0.0 110.29 176.362 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.78 -46.76 88.15 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.527 0.731 . . . . 0.0 111.058 -177.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.445 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -65.74 -41.11 92.55 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.637 178.933 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.708 ' HB3' HG21 ' A' ' 69' ' ' ILE . 1.4 pt20 -67.12 -36.86 82.81 Favored 'General case' 0 C--O 1.206 -1.207 0 CA-C-O 118.937 -0.554 . . . . 0.0 110.091 -179.444 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.5 ' HG2' ' O ' ' A' ' 17' ' ' ARG . 4.2 mmp_? -61.12 -50.37 73.49 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 118.18 0.445 . . . . 0.0 110.899 -178.056 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -64.64 -33.37 75.77 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 123.511 0.507 . . . . 0.0 111.461 177.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.549 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 77.6 mt -77.35 -31.89 54.73 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 122.967 0.507 . . . . 0.0 112.105 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.439 ' HD1' ' O ' ' A' ' 20' ' ' GLN . 3.6 m-85 -65.51 -48.58 72.04 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -179.353 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 20.6 ptt180 -73.02 -26.11 61.2 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.137 178.583 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 38.4 ttm-85 -59.1 -56.86 16.73 Favored 'General case' 0 C--N 1.36 1.059 0 C-N-CA 123.234 0.614 . . . . 0.0 110.513 173.022 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 2.4 pp -82.05 -24.63 35.2 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -173.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 -89.49 27.23 1.51 Allowed 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 123.243 0.617 . . . . 0.0 109.892 171.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.456 ' HZ2' ' HA ' ' A' ' 27' ' ' LEU . 9.8 ptpp? -42.74 -34.11 0.86 Allowed 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 126.541 1.936 . . . . 0.0 114.235 174.877 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.535 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -68.1 -28.98 43.05 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 C-N-CA 124.195 0.998 . . . . 0.0 112.845 -176.835 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -105.68 -24.91 12.44 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 123.557 0.743 . . . . 0.0 110.542 175.148 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -92.34 97.63 10.99 Favored 'General case' 0 C--O 1.243 0.751 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -179.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -59.05 128.1 35.52 Favored 'General case' 0 C--O 1.243 0.736 0 O-C-N 124.041 0.838 . . . . 0.0 110.784 -179.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -66.54 81.36 0.1 Allowed 'General case' 0 N--CA 1.472 0.634 0 O-C-N 124.148 0.905 . . . . 0.0 110.159 172.333 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -93.05 -23.05 18.78 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 114.848 -1.069 . . . . 0.0 109.534 175.513 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 57.28 81.76 0.25 Allowed Pre-proline 0 C--N 1.356 0.872 0 C-N-CA 124.301 1.04 . . . . 0.0 108.959 -170.097 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -56.2 93.46 0.05 OUTLIER 'Trans proline' 0 C--N 1.381 2.251 0 C-N-CA 122.986 2.457 . . . . 0.0 112.748 -176.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 33.4 mmt180 -77.33 -14.98 59.62 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.037 173.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -95.43 142.97 25.33 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 124.797 1.239 . . . . 0.0 108.566 172.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -78.84 9.89 3.1 Favored 'Trans proline' 0 C--N 1.377 2.061 0 C-N-CA 123.083 2.522 . . . . 0.0 113.803 -178.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -67.16 -15.65 63.83 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.964 1.306 . . . . 0.0 112.128 -179.395 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.413 ' HA ' ' HD3' ' A' ' 45' ' ' ARG . 7.7 p-10 -65.41 -13.55 58.92 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.185 0.994 . . . . 0.0 112.393 178.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -52.71 -48.17 66.82 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.594 1.158 . . . . 0.0 111.086 172.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -75.56 -17.26 60.11 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 114.592 -1.185 . . . . 0.0 111.818 -176.165 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.413 ' HD3' ' HA ' ' A' ' 42' ' ' ASP . 9.7 mpt_? -75.24 81.28 2.36 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.465 0.706 . . . . 0.0 109.355 176.096 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -103.88 96.81 6.94 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-N 114.887 -1.051 . . . . 0.0 109.228 177.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.5 m -66.49 89.62 0.15 Allowed 'General case' 0 CA--C 1.547 0.856 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.629 174.447 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -87.17 154.46 20.71 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.584 0.754 . . . . 0.0 109.021 178.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? 61.85 105.67 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.22 0 O-C-N 124.083 0.864 . . . . 0.0 109.672 -165.571 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.6 m -61.07 -84.08 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 123.458 0.703 . . . . 0.0 111.438 -175.395 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.7 p30 167.88 135.33 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 126.231 1.813 . . . . 0.0 107.243 -174.784 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -88.03 -31.75 19.14 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-O 121.253 0.549 . . . . 0.0 110.261 -177.076 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -72.99 150.27 42.6 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 114.897 -1.047 . . . . 0.0 108.951 -179.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 22.0 t -64.33 -51.76 64.27 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 175.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.5 tp 60.31 103.32 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 125.151 1.38 . . . . 0.0 111.976 172.183 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -65.05 -20.4 66.47 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.586 0.754 . . . . 0.0 111.733 -177.044 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -66.42 -14.73 62.58 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 124.2 1.0 . . . . 0.0 112.357 179.105 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.505 HD22 HD13 ' A' ' 27' ' ' LEU . 79.1 mt -79.02 -69.67 0.56 Allowed 'General case' 0 C--N 1.35 0.618 0 C-N-CA 122.918 0.487 . . . . 0.0 111.857 -177.764 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 119.61 124.84 3.28 Favored Glycine 0 N--CA 1.472 1.096 0 N-CA-C 110.641 -0.984 . . . . 0.0 110.641 -175.069 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -58.65 -49.71 76.52 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 124.389 1.076 . . . . 0.0 112.734 -167.039 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.433 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 8.4 p -57.1 -42.74 80.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 O-C-N 124.004 0.815 . . . . 0.0 111.545 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.41 -38.63 70.07 Favored Glycine 0 C--N 1.348 1.199 0 O-C-N 123.82 0.7 . . . . 0.0 112.822 -177.342 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -63.75 -48.47 76.85 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.615 0.766 . . . . 0.0 111.488 -178.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -72.14 -23.57 61.32 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.869 179.415 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 61' ' ' VAL . 12.8 tt0 -74.97 -39.26 61.39 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 176.302 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.441 HD22 HD21 ' A' ' 27' ' ' LEU . 7.2 mp -63.67 -43.14 97.57 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.841 0.856 . . . . 0.0 110.153 173.171 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -60.5 -39.68 88.6 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 123.68 0.612 . . . . 0.0 109.881 179.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.12 -38.57 75.61 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.901 0.88 . . . . 0.0 111.636 178.375 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.708 HG21 ' HB3' ' A' ' 20' ' ' GLN . 78.5 mt -69.88 -57.61 7.76 Favored 'Isoleucine or valine' 0 C--N 1.363 1.153 0 C-N-CA 123.172 0.589 . . . . 0.0 110.765 -179.216 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -62.71 -28.95 70.3 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.368 1.067 . . . . 0.0 111.739 -178.461 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.445 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -69.05 -44.16 73.2 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 122.705 0.402 . . . . 0.0 110.037 172.206 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -66.11 -32.32 73.71 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.817 0.847 . . . . 0.0 111.274 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 90.4 mt -70.7 -37.31 73.57 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.963 0.905 . . . . 0.0 110.254 174.391 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.57 -26.91 65.64 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.758 0.823 . . . . 0.0 111.229 174.247 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.445 ' HG2' ' O ' ' A' ' 71' ' ' ALA . 5.7 mmp_? -70.32 -40.2 74.32 Favored 'General case' 0 C--N 1.357 0.908 0 C-N-CA 122.997 0.519 . . . . 0.0 109.799 173.486 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 81.8 mt -66.12 -43.42 92.21 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.243 0 C-N-CA 123.397 0.679 . . . . 0.0 110.292 178.466 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.29 -39.88 94.41 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.261 1.025 . . . . 0.0 110.775 178.175 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.427 ' HB3' HG22 ' A' ' 80' ' ' THR . 47.1 t -77.13 -24.73 51.62 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.677 0.791 . . . . 0.0 111.299 177.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 86.82 13.42 66.95 Favored Glycine 0 C--N 1.347 1.177 0 C-N-CA 123.169 0.414 . . . . 0.0 113.045 -176.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.427 HG22 ' HB3' ' A' ' 78' ' ' SER . 14.8 t -110.84 24.38 13.01 Favored 'General case' 0 CA--C 1.557 1.215 0 C-N-CA 124.329 1.051 . . . . 0.0 110.825 -179.087 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -70.95 142.92 51.03 Favored 'General case' 0 N--CA 1.477 0.913 0 O-C-N 121.977 -0.452 . . . . 0.0 109.95 168.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 77.29 26.97 60.56 Favored Glycine 0 C--N 1.346 1.098 0 O-C-N 123.903 0.752 . . . . 0.0 111.741 -173.135 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 49.3 m -122.77 119.71 31.42 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 124.142 0.977 . . . . 0.0 110.028 177.029 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 29.5 t -63.07 94.06 0.07 Allowed 'General case' 0 C--N 1.349 0.572 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 166.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 34.8 m -64.98 -25.73 38.4 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 C-N-CA 124.146 0.978 . . . . 0.0 111.248 -174.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.574 ' HD3' ' HB3' ' A' ' 108' ' ' CYS . 57.7 tttm -73.94 -14.64 61.08 Favored 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 124.723 1.209 . . . . 0.0 112.159 -177.342 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.529 ' HB2' ' HG2' ' A' ' 89' ' ' LYS . 4.3 m -132.31 -21.0 2.35 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -175.926 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 69.95 52.62 18.3 Favored Glycine 0 C--N 1.347 1.173 0 O-C-N 123.228 0.33 . . . . 0.0 112.623 -169.525 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.529 ' HG2' ' HB2' ' A' ' 87' ' ' CYS . 19.5 ptpt -143.88 -167.97 2.73 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.547 0.739 . . . . 0.0 109.558 176.179 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.3 mmm180 -76.65 160.85 29.03 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.962 0.905 . . . . 0.0 113.411 -178.633 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 19.1 mm -104.57 144.18 14.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 114.342 -1.299 . . . . 0.0 107.542 159.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.8 p -73.93 152.97 40.0 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.589 0.756 . . . . 0.0 110.767 176.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -68.45 -36.95 79.75 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.064 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -59.35 -40.4 86.26 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.031 0.933 . . . . 0.0 111.159 175.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 29.4 tpt180 -64.06 -45.32 89.31 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.143 175.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 95.7 mt -71.02 -32.92 69.83 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.407 0.683 . . . . 0.0 112.763 -175.55 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.3 ptpt -81.75 -27.43 33.82 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.489 0.315 . . . . 0.0 110.433 -177.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -78.43 -43.82 26.3 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.588 0.755 . . . . 0.0 110.493 174.672 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.7 p -152.86 95.38 3.03 Favored Pre-proline 0 CA--C 1.557 1.23 0 C-N-CA 124.478 1.111 . . . . 0.0 109.2 -176.039 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -74.44 -9.82 21.8 Favored 'Trans proline' 0 C--N 1.376 2.014 0 C-N-CA 122.615 2.21 . . . . 0.0 112.487 175.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 11.1 p90 -102.92 67.01 0.94 Allowed 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.206 1.002 . . . . 0.0 108.965 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 10.4 t -140.92 117.91 7.74 Favored Pre-proline 0 CA--C 1.551 0.983 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.575 177.435 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.23 -24.34 23.33 Favored 'Trans proline' 0 C--N 1.373 1.838 0 C-N-CA 122.262 1.975 . . . . 0.0 111.8 173.204 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -105.54 144.82 31.77 Favored 'General case' 0 C--N 1.352 0.713 0 CA-C-O 122.305 1.05 . . . . 0.0 111.133 -176.479 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.829 ' SG ' ' HB2' ' A' ' 108' ' ' CYS . 3.5 p -64.3 164.97 10.25 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 113.628 -1.624 . . . . 0.0 110.556 167.648 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.2 tt0 -55.34 -51.82 65.5 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 123.895 0.878 . . . . 0.0 112.367 -174.53 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.56 -29.82 52.34 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -174.569 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.829 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 75.7 m -78.34 -25.61 46.48 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.358 0.263 . . . . 0.0 111.366 177.072 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.05 -35.45 69.33 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 123.705 0.628 . . . . 0.0 109.878 169.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.38 -29.09 63.44 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.82 0.848 . . . . 0.0 112.054 178.425 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -117.32 33.13 5.78 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.689 0.796 . . . . 0.0 111.462 -174.455 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.502 HD23 ' HE3' ' A' ' 86' ' ' LYS . 54.6 mt . . . . . 0 N--CA 1.492 1.628 0 C-N-CA 123.678 0.791 . . . . 0.0 111.25 175.162 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 4.7 tt . . . . . 0 N--CA 1.482 1.171 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 64.04 -77.33 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 125.086 1.354 . . . . 0.0 111.123 -178.633 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -80.65 -64.47 1.81 Allowed Glycine 0 C--N 1.347 1.152 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 172.487 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 85.06 21.97 53.76 Favored Glycine 0 C--N 1.354 1.57 0 N-CA-C 114.148 0.419 . . . . 0.0 114.148 177.084 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? -83.82 -7.05 59.54 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.635 0.774 . . . . 0.0 112.019 -178.512 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 32.7 t -113.65 150.07 33.72 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 171.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 54.9 ttm -65.6 -35.61 81.32 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 122.651 0.381 . . . . 0.0 110.072 177.43 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 58.97 68.81 0.78 Allowed 'General case' 0 C--O 1.246 0.906 0 C-N-CA 124.935 1.294 . . . . 0.0 110.121 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 81.7 t -65.5 -32.44 58.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 CA-C-N 114.238 -1.346 . . . . 0.0 111.135 -177.446 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -59.58 -36.34 76.05 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.191 0.996 . . . . 0.0 112.599 -176.119 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 71.9 m -69.88 -39.21 76.43 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 122.715 0.406 . . . . 0.0 111.064 176.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -68.99 -34.27 75.03 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.098 0.559 . . . . 0.0 110.043 175.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -63.22 -56.23 18.38 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.749 1.22 . . . . 0.0 109.259 -177.049 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.445 ' NZ ' ' HB2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -67.61 -39.84 84.71 Favored 'General case' 0 C--O 1.219 -0.545 0 CA-C-N 115.696 -0.683 . . . . 0.0 112.164 -175.057 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 13.5 tt -64.98 -31.77 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 CA-C-O 120.965 0.412 . . . . 0.0 110.242 -177.7 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.58 ' HB3' HG23 ' A' ' 69' ' ' ILE . 64.4 mt -69.63 -42.0 74.89 Favored 'General case' 0 C--N 1.349 0.556 0 C-N-CA 123.368 0.667 . . . . 0.0 110.847 174.084 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.5 ' O ' ' HG2' ' A' ' 21' ' ' ARG . 1.8 mmp_? -61.67 -46.35 90.1 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 123.388 0.675 . . . . 0.0 110.361 177.304 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -59.11 -47.34 85.61 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.583 0.753 . . . . 0.0 110.551 178.362 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -66.43 -41.27 89.44 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 114.806 -1.088 . . . . 0.0 111.544 -176.165 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.678 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.8 pt20 -71.68 -32.99 68.44 Favored 'General case' 0 C--O 1.212 -0.918 0 CA-C-O 118.525 -0.75 . . . . 0.0 110.673 -177.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.5 ' HG2' ' O ' ' A' ' 17' ' ' ARG . 22.9 mmt180 -67.6 -46.81 71.5 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.192 0.597 . . . . 0.0 110.826 -177.437 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -66.54 -32.88 74.5 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.871 178.193 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.532 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 89.4 mt -77.58 -32.24 53.57 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-O 118.631 -0.7 . . . . 0.0 111.842 176.364 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -58.54 -54.46 46.75 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 123.239 0.616 . . . . 0.0 109.507 178.353 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.5 ptt180 -72.83 -25.84 61.27 Favored 'General case' 0 CA--C 1.549 0.913 0 CA-C-N 114.832 -1.076 . . . . 0.0 111.522 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 52.3 ttm-85 -63.15 -52.08 63.89 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.022 0.529 . . . . 0.0 112.102 175.509 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.63 HD21 HD22 ' A' ' 66' ' ' LEU . 2.9 pp -81.44 -25.67 35.94 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 122.334 -0.229 . . . . 0.0 111.02 -178.81 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 6.1 m170 -86.87 32.26 0.68 Allowed 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 122.952 0.501 . . . . 0.0 110.594 169.206 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 20.2 pttp -61.63 -29.42 70.04 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 124.511 1.124 . . . . 0.0 112.069 176.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.512 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -63.9 -26.11 39.78 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 123.521 0.728 . . . . 0.0 111.618 174.96 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -97.45 -34.21 11.1 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.459 1.104 . . . . 0.0 110.551 177.208 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -89.75 118.93 29.72 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.133 -0.939 . . . . 0.0 110.72 -171.228 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -73.79 -7.85 53.74 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.781 0.832 . . . . 0.0 111.309 173.438 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 63.8 t80 67.16 75.47 0.31 Allowed 'General case' 0 C--N 1.356 0.88 0 C-N-CA 125.754 1.621 . . . . 0.0 109.668 179.597 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -71.03 -39.28 72.43 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 114.869 -1.059 . . . . 0.0 109.247 170.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 69.06 110.56 0.03 OUTLIER Pre-proline 0 C--N 1.36 1.048 0 O-C-N 124.977 1.423 . . . . 0.0 110.623 -178.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -69.09 109.85 2.28 Favored 'Trans proline' 0 C--N 1.369 1.613 0 C-N-CA 121.714 1.609 . . . . 0.0 110.047 168.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -61.68 -19.5 62.42 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.06 0.944 . . . . 0.0 111.517 -179.639 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 15.9 p30 -136.67 150.49 70.29 Favored Pre-proline 0 CA--C 1.542 0.665 0 C-N-CA 124.579 1.152 . . . . 0.0 108.312 169.401 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -74.35 75.93 3.26 Favored 'Trans proline' 0 C--N 1.374 1.92 0 C-N-CA 122.439 2.093 . . . . 0.0 110.418 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -72.46 -37.87 68.4 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 114.629 -1.169 . . . . 0.0 108.908 -179.107 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -83.83 73.43 10.31 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 114.31 -1.314 . . . . 0.0 109.869 176.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -59.39 -48.02 83.21 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 114.654 -1.157 . . . . 0.0 108.97 172.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.474 ' HB2' ' HD3' ' A' ' 17' ' ' ARG . 24.4 t70 -159.9 90.44 0.92 Allowed 'General case' 0 C--O 1.239 0.533 0 CA-C-N 114.339 -1.301 . . . . 0.0 108.012 168.1 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -97.62 52.82 1.11 Allowed 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 -178.537 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 64.96 153.1 0.06 Allowed 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 125.135 1.374 . . . . 0.0 112.467 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.9 p -118.82 -83.09 0.65 Allowed 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 175.18 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 61.78 168.56 0.11 Allowed 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.689 1.196 . . . . 0.0 112.926 174.662 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 52.78 -96.22 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.709 1.204 . . . . 0.0 110.13 -173.413 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.8 m 57.19 170.03 0.04 OUTLIER 'General case' 0 C--N 1.363 1.181 0 C-N-CA 125.416 1.486 . . . . 0.0 112.407 -177.088 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.0 t-20 66.03 177.91 0.21 Allowed 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.607 0.763 . . . . 0.0 109.97 177.497 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.4 t70 64.49 17.25 10.73 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 122.188 0.994 . . . . 0.0 110.21 -176.44 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -88.18 70.89 9.26 Favored 'General case' 0 C--O 1.246 0.884 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 -179.498 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 41.7 t -66.98 -25.31 34.02 Favored 'Isoleucine or valine' 0 C--O 1.241 0.613 0 CA-C-N 113.714 -1.585 . . . . 0.0 110.666 -173.715 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.8 tp -56.15 110.84 0.82 Allowed 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.94 0.896 . . . . 0.0 110.547 178.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -79.25 -3.15 44.54 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 123.69 0.796 . . . . 0.0 111.264 -174.794 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -66.78 -12.36 58.53 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.569 0.748 . . . . 0.0 111.861 174.113 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 12.5 mt -73.79 131.74 41.87 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 171.139 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -60.79 130.74 48.38 Favored Glycine 0 C--N 1.346 1.085 0 CA-C-O 119.074 -0.848 . . . . 0.0 111.906 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -64.29 -43.2 95.48 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.244 0.617 . . . . 0.0 111.104 -174.464 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 7.8 p -58.9 -35.04 54.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 123.199 0.6 . . . . 0.0 110.958 173.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.43 -43.71 76.82 Favored Glycine 0 C--N 1.345 1.082 0 O-C-N 123.647 0.592 . . . . 0.0 112.205 175.135 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -67.5 -47.87 68.75 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 124.024 0.93 . . . . 0.0 111.554 -176.001 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -67.66 -39.3 84.55 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.445 0.698 . . . . 0.0 110.806 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -70.75 -33.17 70.53 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 123.44 0.463 . . . . 0.0 110.129 179.489 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.63 HD22 HD21 ' A' ' 27' ' ' LEU . 2.5 mp -66.18 -41.33 90.43 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.344 0.658 . . . . 0.0 110.791 173.548 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 56.4 ttt180 -58.05 -42.96 86.55 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 123.656 0.597 . . . . 0.0 109.62 175.737 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.02 -39.71 75.65 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.42 1.088 . . . . 0.0 111.919 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.678 HG21 ' HB3' ' A' ' 20' ' ' GLN . 72.9 mt -68.69 -54.08 23.15 Favored 'Isoleucine or valine' 0 C--N 1.359 1.012 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -178.488 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -67.09 -23.27 65.83 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.331 1.052 . . . . 0.0 112.605 179.557 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.467 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -65.85 -54.56 25.1 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 170.505 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.486 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -58.81 -42.38 89.03 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 124.448 1.092 . . . . 0.0 111.339 -178.361 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.508 HD23 HD12 ' A' ' 76' ' ' ILE . 95.5 mt -68.04 -38.42 82.49 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.319 1.047 . . . . 0.0 111.721 179.469 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.34 -33.0 74.93 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.173 0.589 . . . . 0.0 110.394 174.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.467 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 80.5 mtt-85 -74.91 -27.4 60.2 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.588 0.755 . . . . 0.0 111.36 177.869 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.508 HD12 HD23 ' A' ' 73' ' ' LEU . 76.2 mt -69.89 -44.6 78.63 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 174.129 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.37 -32.97 74.88 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 114.825 -1.08 . . . . 0.0 111.324 176.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 26.6 t -84.08 -23.2 30.91 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.439 0.696 . . . . 0.0 111.627 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 86.95 16.63 60.86 Favored Glycine 0 C--N 1.35 1.31 0 O-C-N 123.298 0.374 . . . . 0.0 113.785 -178.549 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.4 t -114.36 18.83 16.68 Favored 'General case' 0 CA--C 1.559 1.291 0 C-N-CA 124.111 0.964 . . . . 0.0 111.372 178.361 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -72.66 137.61 46.15 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 170.096 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.453 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 88.5 11.42 66.37 Favored Glycine 0 CA--C 1.528 0.857 0 O-C-N 123.987 0.804 . . . . 0.0 111.918 -171.444 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 22.7 m -118.79 118.2 30.95 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.511 0.724 . . . . 0.0 109.656 175.409 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 46.5 t -74.2 92.84 2.26 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.898 171.401 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 27.0 m -66.84 -14.45 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 124.041 0.936 . . . . 0.0 112.755 -177.648 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 47.7 tttm -76.49 -17.41 59.3 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.152 0.581 . . . . 0.0 111.844 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 31.0 p -144.26 8.6 1.4 Allowed 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 176.506 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 62.43 32.38 82.82 Favored Glycine 0 C--N 1.358 1.759 0 C-N-CA 123.247 0.451 . . . . 0.0 114.196 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 32.3 mmmt -116.05 -171.39 1.98 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.499 0.72 . . . . 0.0 110.067 -176.51 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.453 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 24.2 tpp180 -89.12 151.42 22.22 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.176 0.991 . . . . 0.0 110.364 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 9.8 mm -92.5 138.74 19.32 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 165.011 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 39.0 m -73.92 151.38 40.41 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 122.619 0.368 . . . . 0.0 110.54 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -61.36 -41.43 97.06 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.405 0.682 . . . . 0.0 109.896 174.396 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.421 ' HA ' ' HG2' ' A' ' 97' ' ' LYS . 64.0 m-20 -67.13 -33.58 75.75 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.286 178.369 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.455 ' HG3' HG21 ' A' ' 102' ' ' THR . 1.0 OUTLIER -66.43 -44.1 83.81 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.42 0.688 . . . . 0.0 109.583 174.918 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 79.4 mt -71.19 -36.01 71.78 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.764 0.826 . . . . 0.0 112.037 -177.161 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.421 ' HG2' ' HA ' ' A' ' 94' ' ' ASP . 16.0 ptpt -77.08 -28.18 54.52 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 110.256 -0.275 . . . . 0.0 110.256 -177.715 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -79.12 -40.48 30.95 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.493 0.717 . . . . 0.0 110.732 175.768 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.2 p -152.61 94.3 3.19 Favored Pre-proline 0 CA--C 1.556 1.183 0 C-N-CA 124.625 1.17 . . . . 0.0 108.79 -176.571 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.98 -13.1 19.54 Favored 'Trans proline' 0 C--N 1.375 1.935 0 C-N-CA 122.61 2.207 . . . . 0.0 113.816 -179.42 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 36.2 p90 -90.69 7.71 38.12 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -179.399 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.455 HG21 ' HG3' ' A' ' 95' ' ' ARG . 15.0 t -82.74 123.77 77.9 Favored Pre-proline 0 CA--C 1.562 1.418 0 CA-C-N 118.112 0.415 . . . . 0.0 110.735 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -84.29 0.63 9.09 Favored 'Trans proline' 0 C--N 1.368 1.605 0 C-N-CA 122.61 2.207 . . . . 0.0 111.645 167.261 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -117.39 141.63 48.09 Favored 'General case' 0 C--N 1.353 0.744 0 C-N-CA 123.929 0.892 . . . . 0.0 110.577 -173.055 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.64 ' SG ' ' HG3' ' A' ' 107' ' ' GLU . 19.8 p -80.18 173.48 12.56 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 174.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -60.96 -35.08 75.84 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -172.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.64 ' HG3' ' SG ' ' A' ' 105' ' ' CYS . 0.0 OUTLIER -72.24 -32.64 66.88 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 178.48 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 91.8 m -73.87 -38.8 64.31 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 122.452 0.301 . . . . 0.0 110.784 173.503 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.91 -32.54 74.3 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.129 0.972 . . . . 0.0 111.187 175.589 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.25 -33.45 69.83 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.74 0.816 . . . . 0.0 110.708 174.425 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -79.4 -10.73 59.87 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.852 177.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 90.3 mt . . . . . 0 C--O 1.25 1.119 0 CA-C-O 118.452 -0.785 . . . . 0.0 109.105 173.013 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.3 pp . . . . . 0 N--CA 1.488 1.426 0 CA-C-O 119.622 -0.228 . . . . 0.0 110.65 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 69.12 169.78 0.29 Allowed 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 124.795 1.238 . . . . 0.0 113.006 177.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 90.44 178.43 44.1 Favored Glycine 0 C--N 1.347 1.181 0 CA-C-N 116.065 -0.516 . . . . 0.0 113.294 177.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -165.62 116.72 0.71 Allowed Glycine 0 C--N 1.347 1.145 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -96.26 56.36 1.6 Allowed 'General case' 0 N--CA 1.48 1.075 0 CA-C-O 121.696 0.76 . . . . 0.0 109.847 -175.373 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.2 t -174.73 168.99 3.62 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.575 1.15 . . . . 0.0 109.669 178.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 48.4 ttp 63.05 12.9 6.3 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 124.917 1.287 . . . . 0.0 112.271 172.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 16.7 m120 63.82 25.47 14.08 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 124.839 1.256 . . . . 0.0 112.061 -175.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.401 HG22 ' HD2' ' A' ' 81' ' ' PHE . 37.7 t -50.04 -42.38 19.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 C-N-CA 124.535 1.134 . . . . 0.0 111.817 178.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -70.62 -36.17 73.33 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 123.855 0.722 . . . . 0.0 111.925 -175.135 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 57.5 m -68.3 -35.77 78.33 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 173.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.419 ' HA ' HG22 ' A' ' 15' ' ' ILE . 23.1 m-85 -70.3 -36.47 74.35 Favored 'General case' 0 C--O 1.215 -0.758 0 C-N-CA 123.252 0.621 . . . . 0.0 110.403 176.404 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -63.31 -52.19 62.92 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.207 1.003 . . . . 0.0 110.303 -175.315 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.82 -42.3 95.09 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.471 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.527 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 10.6 tt -69.2 -32.76 55.1 Favored 'Isoleucine or valine' 0 C--N 1.365 1.261 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 -177.039 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.45 ' HB3' HG23 ' A' ' 69' ' ' ILE . 52.8 mt -62.78 -41.87 99.44 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 122.793 0.437 . . . . 0.0 110.451 175.438 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.523 ' O ' ' HG2' ' A' ' 21' ' ' ARG . 17.4 mtm180 -60.83 -52.62 64.28 Favored 'General case' 0 C--O 1.215 -0.737 0 O-C-N 123.626 0.579 . . . . 0.0 109.448 175.232 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -53.95 -44.86 71.06 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.43 0.692 . . . . 0.0 111.422 -176.784 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.527 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -61.44 -51.21 69.67 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 124.306 1.004 . . . . 0.0 110.867 178.956 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.666 ' HB3' HG21 ' A' ' 69' ' ' ILE . 1.8 pt20 -67.83 -29.84 69.09 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 122.983 0.177 . . . . 0.0 110.941 -176.071 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.597 ' HB3' ' HB2' ' A' ' 47' ' ' SER . 29.2 mmt180 -71.41 -54.39 10.84 Favored 'General case' 0 C--N 1.354 0.781 0 C-N-CA 123.623 0.769 . . . . 0.0 110.131 -177.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -61.63 -29.93 70.37 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.109 0.564 . . . . 0.0 110.584 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.617 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 82.5 mt -69.83 -43.32 72.22 Favored 'General case' 0 C--O 1.212 -0.869 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.94 170.861 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.43 ' O ' ' HB2' ' A' ' 28' ' ' HIS . 2.0 m-85 -56.83 -37.15 70.84 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.099 0.56 . . . . 0.0 112.062 -177.612 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.442 HH11 ' HG3' ' A' ' 36' ' ' GLU . 35.7 ptt180 -80.46 -29.7 37.47 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 122.169 0.187 . . . . 0.0 111.172 174.731 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 47.7 ttt85 -66.83 -37.77 85.13 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.95 0.9 . . . . 0.0 112.23 177.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.617 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 1.7 pp -97.22 -35.48 10.74 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 122.473 0.309 . . . . 0.0 111.288 -177.203 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.43 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 52.1 m-70 -92.2 45.57 1.21 Allowed 'General case' 0 N--CA 1.486 1.335 0 CA-C-O 122.242 1.02 . . . . 0.0 109.341 168.527 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 18.7 pttp -65.12 -21.33 66.78 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 125.502 1.521 . . . . 0.0 112.017 174.223 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.421 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -64.28 -25.82 38.92 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 123.187 0.595 . . . . 0.0 112.226 178.58 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -113.92 -20.0 11.23 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.763 0.825 . . . . 0.0 110.9 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -92.98 85.3 5.08 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 175.477 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -105.91 84.3 2.04 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.848 0.859 . . . . 0.0 110.547 -177.399 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 21.5 t80 62.75 18.71 10.88 Favored 'General case' 0 CA--C 1.562 1.412 0 C-N-CA 124.846 1.258 . . . . 0.0 112.374 170.474 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -61.63 -43.31 99.1 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-O 121.979 0.895 . . . . 0.0 109.383 175.782 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.442 ' HG3' HH11 ' A' ' 25' ' ' ARG . 10.2 pt-20 -145.14 112.92 4.81 Favored Pre-proline 0 CA--C 1.549 0.911 0 CA-C-N 113.891 -1.504 . . . . 0.0 107.74 167.345 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.48 178.74 6.96 Favored 'Trans proline' 0 C--N 1.37 1.662 0 C-N-CA 122.662 2.241 . . . . 0.0 112.76 177.379 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 37.5 ptt180 -52.7 125.57 17.12 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 125.542 1.537 . . . . 0.0 112.16 -177.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -135.83 84.21 32.88 Favored Pre-proline 0 CA--C 1.551 1.009 0 C-N-CA 123.387 0.675 . . . . 0.0 109.298 176.174 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -75.49 -23.33 13.12 Favored 'Trans proline' 0 C--N 1.384 2.399 0 C-N-CA 123.059 2.506 . . . . 0.0 112.398 -179.22 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -91.08 171.01 9.55 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 124.296 1.038 . . . . 0.0 109.946 174.171 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -72.78 86.82 1.26 Allowed 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 123.512 0.725 . . . . 0.0 111.445 -171.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -114.01 -54.99 2.55 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.122 0.969 . . . . 0.0 108.637 172.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.7 t70 61.25 100.03 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.959 1.304 . . . . 0.0 111.756 175.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 22.5 mmt180 -102.08 -77.72 0.55 Allowed 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 122.749 0.42 . . . . 0.0 110.363 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -161.51 -80.7 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 117.847 0.294 . . . . 0.0 111.062 176.359 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.597 ' HB2' ' HB3' ' A' ' 21' ' ' ARG . 19.3 m 57.58 27.1 13.65 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 125.066 1.346 . . . . 0.0 110.815 -170.629 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.577 ' HG3' ' HG3' ' A' ' 49' ' ' ARG . 10.3 tp10 -57.94 -59.13 5.72 Favored 'General case' 0 C--N 1.353 0.719 0 C-N-CA 125.002 1.321 . . . . 0.0 112.603 -165.198 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.577 ' HG3' ' HG3' ' A' ' 48' ' ' GLU . 99.7 mtt180 -136.21 169.06 18.24 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.643 0.735 . . . . 0.0 111.258 -174.701 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.8 t -162.91 -171.57 2.73 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 113.946 -1.479 . . . . 0.0 107.995 -173.461 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -68.77 112.94 5.8 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 165.066 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -69.71 -18.26 63.52 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.497 0.719 . . . . 0.0 111.831 -171.153 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -67.79 158.98 31.2 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 122.907 0.483 . . . . 0.0 110.822 175.256 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 90.1 t -69.4 -79.26 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.578 -173.064 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.489 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 65.5 tp 70.77 137.42 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.851 0 C-N-CA 124.569 1.147 . . . . 0.0 110.655 -172.702 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -81.06 15.74 1.76 Allowed 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -175.234 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -91.94 2.29 56.64 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.439 0.695 . . . . 0.0 111.023 173.444 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 12.4 mt -81.52 167.21 19.56 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.747 0.419 . . . . 0.0 111.046 178.688 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -95.57 132.04 10.92 Favored Glycine 0 C--N 1.346 1.102 0 N-CA-C 110.85 -0.9 . . . . 0.0 110.85 172.075 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -51.62 -51.99 51.25 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 124.49 1.116 . . . . 0.0 112.906 -175.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 7.4 p -66.49 -32.15 56.75 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 C-N-CA 123.851 0.86 . . . . 0.0 111.003 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -63.46 -36.93 94.03 Favored Glycine 0 C--N 1.347 1.174 0 N-CA-C 111.903 -0.479 . . . . 0.0 111.903 175.063 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -76.99 -41.12 44.15 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.312 1.045 . . . . 0.0 111.552 -178.72 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -67.74 -39.06 84.25 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.533 0.733 . . . . 0.0 110.197 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -70.64 -39.7 73.52 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.545 178.423 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.1 mp -56.2 -47.2 78.84 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.024 0.929 . . . . 0.0 110.313 172.514 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -63.37 -37.32 86.8 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.704 0.802 . . . . 0.0 110.693 -176.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.75 -37.8 70.49 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.664 0.786 . . . . 0.0 111.182 178.031 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.666 HG21 ' HB3' ' A' ' 20' ' ' GLN . 85.4 mt -67.32 -52.24 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 123.973 0.909 . . . . 0.0 110.51 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.8 -29.74 70.72 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.24 1.016 . . . . 0.0 111.213 -179.17 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.405 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -65.4 -46.14 81.19 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 122.973 0.509 . . . . 0.0 110.043 173.604 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.51 ' HB1' ' HE1' ' A' ' 81' ' ' PHE . . . -66.42 -39.98 89.28 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.391 179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.512 HD23 HD12 ' A' ' 76' ' ' ILE . 68.3 mt -69.83 -32.17 70.45 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.06 0.944 . . . . 0.0 111.188 178.508 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.54 -34.82 79.14 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.348 0.659 . . . . 0.0 110.544 174.439 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.405 ' HG2' ' O ' ' A' ' 71' ' ' ALA . 17.8 mmt180 -72.04 -37.95 69.63 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.501 176.71 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.512 HD12 HD23 ' A' ' 73' ' ' LEU . 59.6 mt -65.69 -41.62 90.88 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 CA-C-O 121.224 0.535 . . . . 0.0 109.629 175.636 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -67.66 -25.06 65.52 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.438 1.095 . . . . 0.0 111.933 178.121 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 27.5 t -100.37 2.58 42.54 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 123.739 0.816 . . . . 0.0 111.084 177.372 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 66.51 19.64 69.06 Favored Glycine 0 C--N 1.358 1.771 0 N-CA-C 114.452 0.541 . . . . 0.0 114.452 176.236 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 9.0 t -127.4 29.2 5.57 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 124.519 1.127 . . . . 0.0 110.873 -177.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.51 ' HE1' ' HB1' ' A' ' 72' ' ' ALA . 68.5 t80 -59.35 143.67 48.84 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 122.821 0.449 . . . . 0.0 110.317 167.377 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 83.48 33.63 21.93 Favored Glycine 0 C--N 1.34 0.757 0 O-C-N 123.779 0.674 . . . . 0.0 111.623 -173.65 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 59.1 m -125.66 120.36 30.51 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.385 0.674 . . . . 0.0 110.074 175.196 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.423 ' HB2' ' HB3' ' A' ' 105' ' ' CYS . 48.7 t -76.66 102.18 6.06 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 123.807 0.843 . . . . 0.0 110.613 175.131 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 16.4 m -74.2 -11.45 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 124.157 0.983 . . . . 0.0 112.408 -175.117 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 52.4 tttm -81.03 -24.83 37.61 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.073 0.549 . . . . 0.0 111.381 -178.573 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.439 ' SG ' ' HB2' ' A' ' 89' ' ' LYS . 23.3 p -139.01 11.3 2.62 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 -178.487 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 62.21 26.66 67.98 Favored Glycine 0 C--N 1.353 1.512 0 N-CA-C 114.0 0.36 . . . . 0.0 114.0 -179.375 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.439 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 85.5 mttt -103.66 -168.89 1.56 Allowed 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.373 0.669 . . . . 0.0 110.853 -179.251 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 1.8 tmt_? -96.98 159.56 14.84 Favored 'General case' 0 CA--C 1.559 1.322 0 C-N-CA 124.796 1.239 . . . . 0.0 107.718 176.21 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 9.1 mm -96.25 134.21 34.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 171.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.1 m -61.73 143.64 55.89 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.476 0.711 . . . . 0.0 110.314 177.471 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -66.25 -38.08 87.0 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 118.104 0.411 . . . . 0.0 110.724 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -57.76 -40.1 78.95 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.489 0.715 . . . . 0.0 110.786 173.104 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.581 ' HG3' HG21 ' A' ' 102' ' ' THR . 25.2 tpt180 -66.32 -42.28 88.43 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.427 176.651 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 83.9 mt -68.93 -38.15 79.34 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.784 0.834 . . . . 0.0 112.628 -176.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -78.67 -32.16 47.04 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 122.399 0.28 . . . . 0.0 110.339 -176.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.65 -38.14 65.07 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.469 0.708 . . . . 0.0 110.749 176.341 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 1.7 p -155.61 99.52 2.25 Favored Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 124.773 1.229 . . . . 0.0 108.911 -178.689 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -73.02 -15.88 25.83 Favored 'Trans proline' 0 C--N 1.371 1.73 0 C-N-CA 122.445 2.096 . . . . 0.0 113.173 176.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 19.5 p90 -95.0 64.68 2.83 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 122.251 1.025 . . . . 0.0 109.333 179.378 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.581 HG21 ' HG3' ' A' ' 95' ' ' ARG . 13.5 t -137.94 108.53 8.32 Favored Pre-proline 0 CA--C 1.559 1.315 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.061 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.28 -8.03 18.34 Favored 'Trans proline' 0 C--N 1.371 1.757 0 C-N-CA 122.668 2.245 . . . . 0.0 112.056 169.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -104.68 140.22 38.37 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.06 0.944 . . . . 0.0 109.558 -178.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.423 ' HB3' ' HB2' ' A' ' 84' ' ' CYS . 30.3 p -78.06 169.89 17.51 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 174.738 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -52.67 -37.72 59.22 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 123.518 0.727 . . . . 0.0 111.067 -178.274 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -57.85 -54.56 45.58 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.316 174.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 93.2 m -70.25 -26.82 64.01 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.387 -174.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.61 -44.05 87.76 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.78 0.832 . . . . 0.0 110.151 174.479 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -74.48 -20.1 60.13 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.439 177.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -95.32 3.88 54.0 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.107 0.963 . . . . 0.0 112.578 -177.388 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 92.4 mt . . . . . 0 N--CA 1.484 1.235 0 CA-C-O 119.228 -0.415 . . . . 0.0 110.664 178.279 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.488 HD11 HG22 ' A' ' 76' ' ' ILE . 2.5 tm? . . . . . 0 N--CA 1.484 1.242 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 64.94 176.81 0.2 Allowed 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 125.097 1.359 . . . . 0.0 112.613 -178.47 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 73.49 -81.55 0.72 Allowed Glycine 0 C--N 1.341 0.857 0 N-CA-C 110.562 -1.015 . . . . 0.0 110.562 -171.339 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 70.53 -80.58 0.41 Allowed Glycine 0 C--N 1.351 1.392 0 CA-C-O 119.743 -0.476 . . . . 0.0 113.375 174.301 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 68.52 135.26 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 126.161 1.784 . . . . 0.0 111.268 -171.89 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 30.7 p -73.58 92.39 1.92 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 123.369 0.667 . . . . 0.0 109.819 176.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' MET . . . . . 0.514 ' HB3' HG23 ' A' ' 9' ' ' VAL . 34.7 ttm -152.26 11.84 0.55 Allowed 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.341 1.056 . . . . 0.0 109.306 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.8 m120 63.79 33.21 12.98 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 124.101 0.961 . . . . 0.0 110.166 -170.486 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.514 HG23 ' HB3' ' A' ' 7' ' ' MET . 72.7 t -60.55 -37.58 75.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 123.95 0.9 . . . . 0.0 111.435 -178.327 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -69.27 -31.84 70.63 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.142 0.577 . . . . 0.0 111.008 -179.833 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.3 m -66.71 -39.67 88.12 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.224 0.609 . . . . 0.0 109.974 174.203 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -70.23 -37.57 75.01 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.257 176.187 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -60.4 -53.57 56.01 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.533 1.133 . . . . 0.0 110.25 -175.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -64.75 -45.04 88.14 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.758 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.451 ' O ' ' HB2' ' A' ' 19' ' ' ARG . 10.9 tt -66.11 -32.37 57.84 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.263 0 N-CA-C 110.28 -0.267 . . . . 0.0 110.28 -174.401 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.615 ' HB3' HG23 ' A' ' 69' ' ' ILE . 69.7 mt -73.27 -38.05 66.07 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.019 0.928 . . . . 0.0 111.136 177.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.619 ' HE ' HD13 ' A' ' 73' ' ' LEU . 15.2 mmt85 -64.49 -41.96 96.15 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.52 0.728 . . . . 0.0 111.109 175.267 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -69.13 -35.92 76.92 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.559 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.451 ' HB2' ' O ' ' A' ' 15' ' ' ILE . 8.4 tpt180 -65.99 -48.96 69.47 Favored 'General case' 0 C--N 1.346 0.448 0 CA-C-N 114.341 -1.3 . . . . 0.0 110.799 -177.294 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.669 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.8 pt20 -70.76 -33.83 71.2 Favored 'General case' 0 C--O 1.216 -0.696 0 CA-C-O 118.947 -0.549 . . . . 0.0 110.96 -174.194 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 17' ' ' ARG . 32.5 mmt180 -76.4 -38.39 55.72 Favored 'General case' 0 C--N 1.362 1.144 0 O-C-N 123.456 0.473 . . . . 0.0 111.951 -176.084 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -67.43 -40.72 85.48 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 177.14 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.557 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 97.1 mt -69.73 -36.25 75.69 Favored 'General case' 0 C--N 1.346 0.442 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.505 175.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.449 ' HB2' ' O ' ' A' ' 20' ' ' GLN . 0.2 OUTLIER -58.61 -54.74 43.63 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.84 0.856 . . . . 0.0 110.318 -178.02 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.478 HH22 ' H ' ' A' ' 44' ' ' ASP . 6.9 ptm180 -69.11 -28.03 66.11 Favored 'General case' 0 CA--C 1.551 1.005 0 O-C-N 124.071 0.857 . . . . 0.0 110.815 -177.866 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 50.5 ttt85 -61.96 -55.04 33.49 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.826 0.85 . . . . 0.0 111.257 174.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.703 ' HB2' ' HA ' ' A' ' 58' ' ' LEU . 3.2 pp -82.51 -9.0 59.6 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 122.791 0.436 . . . . 0.0 111.904 -178.092 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 11.6 m170 -102.71 35.85 2.36 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.987 0.915 . . . . 0.0 109.017 171.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -58.27 -27.42 64.01 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.804 1.242 . . . . 0.0 112.578 175.148 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.567 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -65.08 -34.27 69.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.444 0.698 . . . . 0.0 112.136 178.86 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -104.13 -12.51 16.69 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.591 0.756 . . . . 0.0 110.864 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -133.19 69.99 1.47 Allowed 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.965 0.906 . . . . 0.0 109.216 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -94.78 111.92 23.68 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 114.609 -1.178 . . . . 0.0 109.91 -178.697 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -103.43 102.51 12.43 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.412 0.685 . . . . 0.0 109.553 178.198 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -68.26 -45.95 71.76 Favored 'General case' 0 N--CA 1.481 1.122 0 CA-C-O 121.713 0.768 . . . . 0.0 109.459 173.117 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -72.27 171.82 8.81 Favored Pre-proline 0 CA--C 1.557 1.227 0 CA-C-N 113.603 -1.635 . . . . 0.0 110.45 177.389 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -53.86 145.65 49.91 Favored 'Trans proline' 0 C--N 1.387 2.582 0 C-N-CA 122.267 1.978 . . . . 0.0 112.13 172.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 49.9 mtp180 -62.46 -26.83 68.73 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.621 -178.071 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 71.64 140.71 0.08 OUTLIER Pre-proline 0 CA--C 1.552 1.032 0 C-N-CA 125.733 1.613 . . . . 0.0 111.133 -178.676 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_endo -77.75 9.86 2.8 Favored 'Trans proline' 0 C--N 1.377 2.057 0 C-N-CA 122.823 2.349 . . . . 0.0 112.894 -178.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -112.6 150.58 31.19 Favored 'General case' 0 C--O 1.242 0.709 0 C-N-CA 124.528 1.131 . . . . 0.0 109.303 177.096 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -74.18 123.26 24.15 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.516 178.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -70.28 -48.94 54.53 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.063 0.945 . . . . 0.0 110.218 176.195 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.478 ' H ' HH22 ' A' ' 25' ' ' ARG . 20.2 t70 -164.63 134.51 3.86 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 114.72 -1.127 . . . . 0.0 108.434 -177.786 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 78.2 ttt180 -59.08 -47.62 84.59 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.252 1.021 . . . . 0.0 112.106 -173.618 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -164.45 129.88 2.81 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.161 0.584 . . . . 0.0 110.018 -177.567 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.6 t -79.98 175.92 10.2 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.01 0.524 . . . . 0.0 109.733 172.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.473 ' HG2' ' HD2' ' A' ' 49' ' ' ARG . 20.1 tt0 -66.2 -89.54 0.01 OUTLIER 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 123.031 0.532 . . . . 0.0 110.068 -179.605 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.473 ' HD2' ' HG2' ' A' ' 48' ' ' GLU . 2.8 mpt_? -145.0 -64.79 0.34 Allowed 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 174.608 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.7 m 62.37 -69.95 0.06 Allowed 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.628 1.571 . . . . 0.0 112.338 -178.161 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -70.59 86.19 0.64 Allowed 'General case' 0 CA--C 1.55 0.956 0 CA-C-O 121.398 0.618 . . . . 0.0 109.412 172.056 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -79.23 -27.38 42.44 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.739 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -78.0 178.24 7.65 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.142 0.977 . . . . 0.0 111.612 179.394 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 85.0 t -73.97 -67.59 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 173.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.462 HD21 HG21 ' A' ' 30' ' ' ILE . 33.4 tp 65.48 135.68 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 125.502 1.521 . . . . 0.0 112.924 178.756 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -65.52 -24.13 67.05 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.863 0.865 . . . . 0.0 112.42 -176.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.401 ' H ' ' HG ' ' A' ' 55' ' ' LEU . 26.4 mm-40 -65.68 -21.7 66.57 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.245 0.618 . . . . 0.0 111.783 -179.852 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.703 ' HA ' ' HB2' ' A' ' 27' ' ' LEU . 6.8 mp -83.09 109.78 17.44 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.276 -0.875 . . . . 0.0 109.021 168.746 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -77.97 149.25 34.21 Favored Glycine 0 C--N 1.346 1.117 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.784 -175.256 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -57.18 -49.35 76.25 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.551 1.141 . . . . 0.0 112.521 -175.311 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 9.8 p -61.06 -38.0 78.6 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.772 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.51 -51.38 31.68 Favored Glycine 0 C--N 1.348 1.23 0 O-C-N 123.704 0.628 . . . . 0.0 112.497 -179.042 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -64.1 -47.39 80.21 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.564 0.746 . . . . 0.0 111.235 -175.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.25 -22.86 59.14 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.751 -177.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -74.51 -44.81 49.55 Favored 'General case' 0 C--O 1.209 -1.035 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 173.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.44 HD11 ' HB2' ' A' ' 23' ' ' LEU . 5.1 mp -55.74 -43.24 76.44 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 124.122 0.969 . . . . 0.0 110.72 173.456 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 55.7 ttt180 -57.77 -45.93 85.28 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.252 1.021 . . . . 0.0 110.898 176.766 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -73.74 -33.47 64.34 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.438 -179.208 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.669 HG21 ' HB3' ' A' ' 20' ' ' GLN . 66.7 mt -69.18 -51.22 45.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.127 0.971 . . . . 0.0 109.226 -178.734 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -65.88 -27.04 67.92 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.182 0.993 . . . . 0.0 111.736 177.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.73 -42.82 81.26 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 122.792 0.437 . . . . 0.0 109.969 172.592 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.445 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -69.39 -39.71 77.82 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.773 0.829 . . . . 0.0 111.374 179.033 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.619 HD13 ' HE ' ' A' ' 17' ' ' ARG . 89.7 mt -72.68 -29.01 63.05 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.153 0.981 . . . . 0.0 110.939 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.36 -35.38 75.8 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.488 0.715 . . . . 0.0 110.164 173.211 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 67.2 mtm180 -64.32 -44.73 90.65 Favored 'General case' 0 C--N 1.355 0.846 0 O-C-N 123.6 0.563 . . . . 0.0 110.483 173.055 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.564 HD12 HD23 ' A' ' 73' ' ' LEU . 63.5 mt -63.35 -45.71 97.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 -179.76 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.78 -29.33 70.55 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.289 1.036 . . . . 0.0 111.717 179.744 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.517 ' HB3' HG22 ' A' ' 80' ' ' THR . 33.5 t -88.57 -12.3 43.1 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 123.964 0.906 . . . . 0.0 111.222 177.609 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 73.58 25.67 71.76 Favored Glycine 0 C--N 1.352 1.464 0 CA-C-N 116.768 -0.197 . . . . 0.0 112.868 -177.589 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.517 HG22 ' HB3' ' A' ' 78' ' ' SER . 14.7 t -123.62 25.82 8.01 Favored 'General case' 0 CA--C 1.556 1.209 0 C-N-CA 124.668 1.187 . . . . 0.0 110.375 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -66.18 140.87 58.22 Favored 'General case' 0 N--CA 1.477 0.913 0 O-C-N 121.538 -0.726 . . . . 0.0 110.232 171.532 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.406 ' HA2' HD11 ' A' ' 96' ' ' LEU . . . 83.63 27.6 38.28 Favored Glycine 0 C--N 1.342 0.906 0 O-C-N 123.732 0.645 . . . . 0.0 111.52 -171.005 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 94.3 m -116.09 122.05 44.0 Favored 'General case' 0 C--O 1.242 0.708 0 C-N-CA 123.656 0.783 . . . . 0.0 110.182 175.193 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 13.1 t -66.51 95.96 0.35 Allowed 'General case' 0 C--N 1.348 0.528 0 C-N-CA 124.31 1.044 . . . . 0.0 108.623 173.434 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 11.8 m -63.29 -29.84 48.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 C-N-CA 123.991 0.916 . . . . 0.0 112.075 -170.274 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -72.09 -21.01 61.56 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.357 1.063 . . . . 0.0 111.081 -179.552 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 6.5 m -119.63 -16.74 8.79 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.752 0.821 . . . . 0.0 112.276 -169.201 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 56.95 47.68 85.06 Favored Glycine 0 C--N 1.355 1.591 0 N-CA-C 111.316 -0.714 . . . . 0.0 111.316 -166.064 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -138.84 -157.58 0.78 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.572 1.149 . . . . 0.0 110.116 -171.113 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 11.4 tpt180 -97.64 145.78 25.96 Favored 'General case' 0 CA--C 1.564 1.485 0 C-N-CA 124.083 0.953 . . . . 0.0 112.47 -176.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 5.4 mm -95.01 148.77 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 164.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.8 m -75.44 144.54 42.1 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 174.383 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -61.67 -37.64 84.83 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.082 0.553 . . . . 0.0 110.326 175.154 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -62.15 -38.43 88.98 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.942 0.897 . . . . 0.0 111.378 177.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.451 ' HG3' HG21 ' A' ' 102' ' ' THR . 30.3 tpt180 -64.28 -40.51 96.12 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.413 175.492 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.406 HD11 ' HA2' ' A' ' 82' ' ' GLY . 97.3 mt -78.15 -32.38 50.24 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 -175.549 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -76.11 -28.18 57.39 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -77.64 -49.56 14.29 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.538 0.735 . . . . 0.0 110.421 173.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.426 ' O ' HG22 ' A' ' 102' ' ' THR . 2.2 p -144.86 96.59 5.04 Favored Pre-proline 0 CA--C 1.558 1.251 0 C-N-CA 124.703 1.201 . . . . 0.0 109.139 -178.542 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' PRO . . . . . 0.447 ' HG2' HD21 ' A' ' 16' ' ' LEU . 55.5 Cg_endo -73.45 -23.57 17.25 Favored 'Trans proline' 0 C--N 1.378 2.123 0 C-N-CA 122.542 2.162 . . . . 0.0 113.569 -179.056 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 46.5 p90 -81.95 -2.26 50.8 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -177.006 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.451 HG21 ' HG3' ' A' ' 95' ' ' ARG . 13.8 t -68.77 122.4 84.75 Favored Pre-proline 0 CA--C 1.558 1.279 0 CA-C-N 118.373 0.533 . . . . 0.0 110.708 -179.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.39 -27.72 18.95 Favored 'Trans proline' 0 C--N 1.371 1.735 0 C-N-CA 122.199 1.933 . . . . 0.0 111.782 173.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.411 ' HB2' ' HB2' ' A' ' 109' ' ' ALA . 12.7 m-85 -104.44 152.18 22.63 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.628 0.771 . . . . 0.0 110.735 -174.414 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.494 ' SG ' ' HB2' ' A' ' 108' ' ' CYS . 30.7 p -72.3 157.47 37.62 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 115.138 -0.937 . . . . 0.0 108.794 170.471 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.416 ' HB2' ' HD3' ' A' ' 95' ' ' ARG . 33.5 tt0 -51.1 -39.76 56.89 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.279 1.031 . . . . 0.0 112.16 -179.3 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -66.9 -48.32 69.08 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 124.182 0.993 . . . . 0.0 109.777 -177.074 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.494 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 85.0 m -82.54 -16.01 50.21 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 114.682 -1.145 . . . . 0.0 112.566 -174.695 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.411 ' HB2' ' HB2' ' A' ' 104' ' ' PHE . . . -85.23 -26.07 26.92 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.52 0.728 . . . . 0.0 109.942 171.249 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -77.59 -23.62 49.9 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.762 0.825 . . . . 0.0 110.175 170.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -72.91 -11.5 60.61 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.797 0.839 . . . . 0.0 111.738 174.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 69.9 mt . . . . . 0 CA--C 1.553 1.091 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 172.043 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 4.7 mp . . . . . 0 N--CA 1.483 1.202 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -160.67 139.21 10.08 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.49 0.716 . . . . 0.0 110.141 -177.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -90.57 10.54 74.28 Favored Glycine 0 C--N 1.343 0.933 0 O-C-N 123.573 0.546 . . . . 0.0 113.391 178.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 85.28 -63.78 4.29 Favored Glycine 0 C--N 1.351 1.391 0 C-N-CA 122.964 0.316 . . . . 0.0 113.268 176.526 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -140.94 -170.24 3.0 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.843 0.857 . . . . 0.0 110.648 -173.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.8 t 67.95 -176.04 0.2 Allowed 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 124.579 1.152 . . . . 0.0 110.043 -175.253 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' MET . . . . . 0.456 ' SD ' HD12 ' A' ' 96' ' ' LEU . 49.1 ttp -73.07 79.65 1.22 Allowed 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 175.356 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -77.3 110.28 11.9 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.502 -170.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 55.4 t -66.54 -28.31 42.95 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 C-N-CA 123.408 0.683 . . . . 0.0 110.595 175.221 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -65.92 -38.9 89.88 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.968 0.907 . . . . 0.0 112.604 -176.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 60.3 p -64.48 -39.76 94.41 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 174.206 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -68.93 -32.56 72.26 Favored 'General case' 0 C--O 1.215 -0.74 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.184 177.094 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.552 ' HG2' HG21 ' A' ' 76' ' ' ILE . 1.4 tm-20 -60.31 -59.3 5.63 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.355 1.062 . . . . 0.0 109.374 -177.309 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt -66.81 -39.67 87.81 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 114.623 -1.171 . . . . 0.0 112.339 -174.243 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.461 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 12.5 tt -66.99 -38.43 81.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 -177.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.581 ' HB3' HG23 ' A' ' 69' ' ' ILE . 66.0 mt -67.84 -39.03 83.9 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 122.986 0.514 . . . . 0.0 111.368 178.714 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 38.3 mmt180 -61.93 -48.16 81.66 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.123 0.569 . . . . 0.0 110.439 178.165 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -62.48 -40.9 98.18 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.261 0.624 . . . . 0.0 110.78 178.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.482 ' HA ' ' HG2' ' A' ' 22' ' ' GLU . 6.3 mpt_? -72.02 -38.1 69.65 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.77 0.828 . . . . 0.0 112.151 -176.423 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.524 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.5 pt20 -68.56 -33.88 74.85 Favored 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.148 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.552 ' HG3' ' H ' ' A' ' 47' ' ' SER . 24.8 mmt180 -77.8 -30.3 51.21 Favored 'General case' 0 C--N 1.349 0.571 0 CA-C-O 118.972 -0.537 . . . . 0.0 112.159 -178.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.482 ' HG2' ' HA ' ' A' ' 19' ' ' ARG . 5.4 pt-20 -70.2 -33.82 72.17 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 174.692 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.57 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 88.1 mt -69.25 -47.58 64.28 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.404 172.315 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.464 ' O ' ' HB2' ' A' ' 28' ' ' HIS . 1.7 m-85 -56.88 -46.61 81.74 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.909 0.883 . . . . 0.0 111.137 -175.708 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.8 ptp180 -68.02 -37.0 80.89 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 122.96 0.504 . . . . 0.0 111.031 177.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.555 HH11 HD23 ' A' ' 23' ' ' LEU . 41.4 ttm180 -62.8 -43.08 99.73 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.037 0.935 . . . . 0.0 112.472 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 1.5 pp -94.67 -15.74 23.7 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.545 0.338 . . . . 0.0 111.836 -177.661 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.464 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 10.1 m170 -103.03 30.45 4.81 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 123.386 0.674 . . . . 0.0 109.434 168.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.52 ' HZ2' HD12 ' A' ' 30' ' ' ILE . 0.0 OUTLIER -52.21 -19.91 2.3 Favored 'General case' 0 N--CA 1.496 1.827 0 C-N-CA 126.093 1.757 . . . . 0.0 114.887 179.555 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.64 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.1 OUTLIER -84.59 -30.44 7.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 123.968 0.907 . . . . 0.0 111.238 -175.489 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -101.06 -30.31 11.67 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.25 0.62 . . . . 0.0 110.372 176.083 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -103.99 118.64 37.16 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.325 1.05 . . . . 0.0 108.176 -178.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -59.88 -28.83 67.88 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.383 0.673 . . . . 0.0 111.978 -175.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -77.62 81.69 4.06 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 123.342 0.657 . . . . 0.0 110.432 177.466 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -70.55 -47.72 58.95 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 168.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -86.72 126.19 64.57 Favored Pre-proline 0 CA--C 1.546 0.822 0 CA-C-N 113.736 -1.575 . . . . 0.0 108.208 169.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -58.45 102.9 0.14 Allowed 'Trans proline' 0 C--N 1.373 1.838 0 C-N-CA 122.848 2.365 . . . . 0.0 111.283 171.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 27.9 mmm180 -82.73 66.2 8.23 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 122.249 1.023 . . . . 0.0 109.972 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -160.86 106.32 1.28 Allowed Pre-proline 0 CA--C 1.549 0.915 0 CA-C-N 113.237 -1.802 . . . . 0.0 106.488 178.281 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -80.17 16.68 1.46 Allowed 'Trans proline' 0 C--N 1.374 1.889 0 C-N-CA 122.959 2.439 . . . . 0.0 113.452 -176.003 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -156.66 165.7 35.51 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.132 0.973 . . . . 0.0 108.721 -175.607 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -77.09 63.91 2.45 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 122.227 1.013 . . . . 0.0 109.385 167.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -65.88 -17.84 64.92 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-N 114.437 -1.256 . . . . 0.0 110.05 -176.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.7 t70 67.66 72.83 0.32 Allowed 'General case' 0 C--N 1.359 1.008 0 C-N-CA 125.123 1.369 . . . . 0.0 109.487 175.297 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 15.9 mmt180 -77.58 -44.57 28.0 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-N 113.984 -1.462 . . . . 0.0 109.693 173.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 47.31 65.4 1.27 Allowed 'General case' 0 C--N 1.364 1.209 0 O-C-N 124.858 1.349 . . . . 0.0 111.019 179.232 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.552 ' H ' ' HG3' ' A' ' 21' ' ' ARG . 14.5 m -57.62 123.1 14.45 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 114.533 -1.212 . . . . 0.0 111.823 -172.072 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.504 ' HB3' HH11 ' A' ' 49' ' ' ARG . 11.9 tp10 -72.76 170.76 13.94 Favored 'General case' 0 CA--C 1.555 1.165 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 173.671 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.504 HH11 ' HB3' ' A' ' 48' ' ' GLU . 6.9 mpt_? 69.14 78.79 0.21 Allowed 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.032 1.333 . . . . 0.0 108.892 -175.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.5 m -72.16 135.85 46.28 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.786 177.354 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 20.5 m120 -74.24 116.14 14.55 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 122.965 0.506 . . . . 0.0 111.008 -176.058 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -74.56 -39.09 62.49 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.661 0.784 . . . . 0.0 109.888 175.094 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -74.94 116.47 15.71 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.386 177.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 92.2 t -70.71 -53.81 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 123.101 0.56 . . . . 0.0 110.03 179.691 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 55.0 tp 70.81 137.52 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 124.905 1.282 . . . . 0.0 111.198 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -70.87 -18.16 62.7 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 123.401 0.68 . . . . 0.0 112.651 -171.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -79.62 25.56 0.33 Allowed 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 -170.231 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.478 HD22 HD13 ' A' ' 27' ' ' LEU . 6.2 mt -96.01 145.4 25.47 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 122.112 -0.368 . . . . 0.0 110.033 -178.737 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -79.18 151.17 34.62 Favored Glycine 0 C--N 1.348 1.242 0 CA-C-O 119.27 -0.739 . . . . 0.0 111.423 172.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -62.43 -51.67 66.62 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.26 0.624 . . . . 0.0 111.594 -176.21 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 8.4 p -60.74 -32.53 52.16 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 123.651 0.78 . . . . 0.0 111.21 175.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.523 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -60.5 -57.0 21.22 Favored Glycine 0 C--N 1.349 1.304 0 O-C-N 123.992 0.807 . . . . 0.0 111.439 175.542 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -63.41 -38.89 92.9 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 124.636 1.174 . . . . 0.0 111.473 -178.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -62.13 -53.25 57.98 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-N 114.85 -1.068 . . . . 0.0 109.66 -175.677 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -70.75 -34.23 71.64 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-N 114.044 -1.435 . . . . 0.0 109.874 -179.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.523 ' HB2' ' O ' ' A' ' 62' ' ' GLY . 14.8 tp -60.71 -53.51 56.58 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.699 1.2 . . . . 0.0 111.001 -178.121 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 80.5 ttt180 -76.16 -29.75 57.84 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 113.742 -1.572 . . . . 0.0 110.171 -173.808 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.4 -47.11 80.42 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.17 0.588 . . . . 0.0 110.263 173.091 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.581 HG23 ' HB3' ' A' ' 16' ' ' LEU . 74.7 mt -62.34 -48.19 89.51 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.661 175.444 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -68.8 -33.29 73.61 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.358 0.663 . . . . 0.0 110.374 -172.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.9 -41.45 74.69 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.382 0.673 . . . . 0.0 109.979 175.045 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.478 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -61.63 -41.44 97.48 Favored 'General case' 0 N--CA 1.481 1.115 0 O-C-N 123.882 0.739 . . . . 0.0 110.948 177.871 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.535 HD23 HD12 ' A' ' 76' ' ' ILE . 92.5 mt -67.93 -38.1 82.46 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.695 1.198 . . . . 0.0 111.53 177.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.67 -31.68 72.82 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.707 175.333 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -75.12 -33.64 61.59 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.748 0.819 . . . . 0.0 111.108 176.21 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.552 HG21 ' HG2' ' A' ' 13' ' ' GLU . 73.0 mt -63.33 -43.04 98.41 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 174.135 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.87 -41.02 99.23 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.166 175.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.433 ' HB3' HG22 ' A' ' 80' ' ' THR . 27.2 t -83.12 -6.64 59.56 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.86 0.864 . . . . 0.0 112.095 -175.075 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.63 26.19 73.55 Favored Glycine 0 C--N 1.354 1.569 0 CA-C-O 120.962 0.201 . . . . 0.0 112.814 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.433 HG22 ' HB3' ' A' ' 78' ' ' SER . 12.4 t -130.67 27.07 4.99 Favored 'General case' 0 CA--C 1.555 1.165 0 C-N-CA 124.59 1.156 . . . . 0.0 110.417 179.326 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -66.17 146.21 54.9 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 166.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.54 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 73.16 33.57 59.13 Favored Glycine 0 C--O 1.216 -0.998 0 O-C-N 123.667 0.604 . . . . 0.0 111.74 -174.664 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 88.2 m -122.09 146.69 46.96 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.337 0.655 . . . . 0.0 109.926 176.425 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 41.2 t -115.47 102.17 9.57 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.738 1.215 . . . . 0.0 109.082 176.473 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 27.3 m -65.49 -24.96 35.74 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 C-N-CA 123.887 0.875 . . . . 0.0 113.07 -174.391 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.546 ' HD2' ' HB3' ' A' ' 108' ' ' CYS . 22.0 ttmm -74.46 -11.05 60.13 Favored 'General case' 0 CA--C 1.559 1.312 0 C-N-CA 123.097 0.559 . . . . 0.0 112.249 -177.032 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 28.0 p -138.92 1.85 2.1 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.882 -0.511 . . . . 0.0 111.722 171.353 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 59.67 31.84 72.32 Favored Glycine 0 C--N 1.356 1.66 0 O-C-N 123.526 0.517 . . . . 0.0 114.179 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 50.4 mtpt -123.88 166.39 15.74 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-N 117.105 0.452 . . . . 0.0 111.215 -174.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.54 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 14.1 tpp180 -69.42 140.57 54.14 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 124.5 1.12 . . . . 0.0 110.876 -179.376 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 17.0 mm -75.54 150.67 6.6 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 123.762 0.825 . . . . 0.0 109.058 171.102 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 44.3 m -70.53 145.67 50.69 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 122.873 0.469 . . . . 0.0 109.769 173.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -58.75 -40.52 84.12 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.716 0.406 . . . . 0.0 110.05 174.131 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.481 ' HA ' ' HE3' ' A' ' 97' ' ' LYS . 36.4 m-20 -64.59 -32.9 74.75 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 114.964 -1.016 . . . . 0.0 111.454 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 4.8 tpm_? -70.72 -40.35 72.85 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.468 176.358 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.456 HD12 ' SD ' ' A' ' 7' ' ' MET . 98.8 mt -72.39 -35.73 68.5 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 123.598 0.561 . . . . 0.0 111.932 -177.89 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.481 ' HE3' ' HA ' ' A' ' 94' ' ' ASP . 15.7 ptpt -74.86 -29.72 61.11 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -77.79 -39.58 43.5 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.585 0.754 . . . . 0.0 111.099 176.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.5 p -157.37 96.27 2.06 Favored Pre-proline 0 CA--C 1.557 1.216 0 C-N-CA 124.53 1.132 . . . . 0.0 109.15 -177.293 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' PRO . . . . . 0.449 ' HG2' HD21 ' A' ' 16' ' ' LEU . 89.3 Cg_endo -78.53 -1.15 11.35 Favored 'Trans proline' 0 C--N 1.378 2.118 0 C-N-CA 122.796 2.331 . . . . 0.0 113.467 -179.454 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 27.1 p90 -108.6 9.81 27.19 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -178.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 12.7 t -76.78 118.47 71.96 Favored Pre-proline 0 CA--C 1.561 1.401 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 175.092 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -76.75 -6.34 16.78 Favored 'Trans proline' 0 C--N 1.376 1.977 0 C-N-CA 122.552 2.168 . . . . 0.0 112.377 178.401 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.536 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 33.0 m-85 -130.19 159.03 38.08 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.663 0.785 . . . . 0.0 109.899 -177.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 17.8 p -82.38 165.03 20.65 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 176.138 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.5 tm0? -49.19 -40.33 32.88 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.597 0.759 . . . . 0.0 111.712 -173.622 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -56.97 -54.23 49.0 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.643 0.777 . . . . 0.0 111.632 177.274 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.546 ' HB3' ' HD2' ' A' ' 86' ' ' LYS . 61.8 m -78.74 -22.14 46.96 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.56 -173.313 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -81.27 -33.05 32.95 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.789 0.835 . . . . 0.0 109.998 179.339 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -78.78 -20.26 50.26 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.674 0.79 . . . . 0.0 110.655 173.495 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -79.73 -17.43 53.57 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.669 0.787 . . . . 0.0 112.165 176.303 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 95.9 mt . . . . . 0 CA--C 1.554 1.127 0 CA-C-O 118.755 -0.64 . . . . 0.0 110.674 179.767 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 84.7 mt . . . . . 0 N--CA 1.48 1.053 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -162.88 98.68 0.97 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.509 0.724 . . . . 0.0 110.004 178.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -88.28 65.07 3.46 Favored Glycine 0 C--N 1.346 1.118 0 N-CA-C 111.533 -0.627 . . . . 0.0 111.533 176.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -141.61 110.13 0.62 Allowed Glycine 0 C--N 1.347 1.158 0 N-CA-C 111.815 -0.514 . . . . 0.0 111.815 -176.742 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -94.08 -24.08 17.72 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.531 0.732 . . . . 0.0 110.399 177.102 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 50.6 m -112.7 172.46 6.91 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.657 1.183 . . . . 0.0 109.374 173.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 13.5 ptm 48.17 37.83 8.84 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 125.853 1.661 . . . . 0.0 110.824 -173.337 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -50.13 101.15 0.03 OUTLIER 'General case' 0 C--N 1.364 1.213 0 CA-C-N 114.051 -1.431 . . . . 0.0 111.591 -169.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 59.1 t -56.67 -28.2 27.12 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.318 0 CA-C-N 114.174 -1.375 . . . . 0.0 112.028 -173.582 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.8 mp0 -62.85 -43.69 98.13 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 124.75 1.22 . . . . 0.0 111.117 -174.398 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.9 m -61.28 -44.91 96.46 Favored 'General case' 0 C--O 1.241 0.64 0 CA-C-N 114.757 -1.111 . . . . 0.0 109.936 175.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.516 ' HA ' HG22 ' A' ' 15' ' ' ILE . 27.8 m-85 -72.83 -29.99 63.67 Favored 'General case' 0 C--O 1.215 -0.733 0 CA-C-N 114.84 -1.073 . . . . 0.0 111.332 -178.268 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.486 ' HG2' HD13 ' A' ' 76' ' ' ILE . 3.4 tm-20 -65.42 -53.07 48.38 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 125.001 1.32 . . . . 0.0 109.002 -174.769 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.6 ptmm? -67.32 -43.17 82.29 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 114.81 -1.087 . . . . 0.0 111.603 -179.289 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.516 HG22 ' HA ' ' A' ' 12' ' ' TYR . 13.2 tt -69.54 -29.45 41.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 CA-C-O 120.779 0.324 . . . . 0.0 110.891 -174.199 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.447 ' HB3' HG23 ' A' ' 69' ' ' ILE . 41.0 mt -64.15 -46.65 83.12 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.736 171.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -64.25 -38.69 91.94 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 123.424 0.453 . . . . 0.0 111.274 178.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -58.66 -51.47 69.78 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.101 0.56 . . . . 0.0 109.661 177.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -64.53 -40.22 95.21 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 124.267 0.979 . . . . 0.0 111.189 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.526 ' HB2' HG21 ' A' ' 69' ' ' ILE . 3.9 tt0 -66.11 -44.62 83.78 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.268 0.627 . . . . 0.0 111.368 -179.109 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.515 ' O ' ' HG2' ' A' ' 25' ' ' ARG . 17.9 mmt180 -76.22 -36.0 58.78 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 119.101 -0.476 . . . . 0.0 111.07 -172.79 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -68.57 -38.45 80.73 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 123.684 0.615 . . . . 0.0 110.144 175.433 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.424 HD22 ' HA2' ' A' ' 62' ' ' GLY . 67.2 mt -67.18 -40.61 86.59 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 122.786 0.435 . . . . 0.0 110.674 175.018 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -55.41 -58.11 9.1 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 124.267 0.98 . . . . 0.0 109.964 -175.076 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.515 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 8.1 ptm180 -64.65 -34.73 78.97 Favored 'General case' 0 CA--C 1.559 1.316 0 O-C-N 124.036 0.835 . . . . 0.0 111.71 177.123 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -63.73 -41.22 98.08 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 123.784 0.834 . . . . 0.0 112.489 -178.583 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.686 HD21 HD22 ' A' ' 66' ' ' LEU . 4.3 pp -89.8 -23.7 21.66 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 122.88 0.472 . . . . 0.0 110.061 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 67.1 m-70 -86.18 32.91 0.61 Allowed 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.328 0.651 . . . . 0.0 109.99 167.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.8 pttp -58.96 -29.46 67.18 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 125.144 1.378 . . . . 0.0 111.925 174.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.526 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -65.12 -34.67 72.16 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.055 0 C-N-CA 123.409 0.683 . . . . 0.0 111.107 173.775 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -85.48 -25.41 26.9 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.061 0.944 . . . . 0.0 110.411 178.036 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -79.08 99.6 7.0 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.269 -0.878 . . . . 0.0 109.376 176.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -58.66 -45.13 90.01 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.61 0.764 . . . . 0.0 110.607 175.64 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -82.69 157.7 23.22 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-N 114.166 -1.379 . . . . 0.0 110.57 -175.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -74.73 1.44 12.39 Favored 'General case' 0 N--CA 1.488 1.445 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.422 171.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.502 ' HB3' ' NH2' ' A' ' 25' ' ' ARG . 90.6 mt-10 79.2 154.22 0.13 Allowed Pre-proline 0 C--N 1.358 0.973 0 C-N-CA 125.874 1.669 . . . . 0.0 112.733 167.113 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -57.52 122.14 11.25 Favored 'Trans proline' 0 C--N 1.382 2.303 0 C-N-CA 122.914 2.409 . . . . 0.0 112.42 173.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 74.2 mtp85 -76.88 -29.15 55.65 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.136 0.574 . . . . 0.0 109.869 170.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -76.18 148.24 80.81 Favored Pre-proline 0 N--CA 1.477 0.889 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.049 170.723 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -61.44 99.65 0.17 Allowed 'Trans proline' 0 C--N 1.378 2.123 0 C-N-CA 122.458 2.105 . . . . 0.0 111.076 177.254 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -158.49 96.59 1.41 Allowed 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.831 -171.453 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -174.52 -57.91 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 125.419 1.488 . . . . 0.0 107.357 163.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 36.56 69.05 0.22 Allowed 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 126.456 1.902 . . . . 0.0 113.983 176.313 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.491 ' HB3' ' HD2' ' A' ' 21' ' ' ARG . 16.6 t70 -87.78 127.53 35.32 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 174.279 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -130.44 25.51 5.12 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 174.752 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -112.42 -61.5 1.72 Allowed 'General case' 0 C--N 1.353 0.718 0 C-N-CA 123.548 0.739 . . . . 0.0 111.857 -170.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 71.6 p -76.87 100.91 5.7 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 122.918 0.487 . . . . 0.0 111.812 -169.021 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -85.83 100.06 11.8 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 171.717 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 31.5 mmm180 -123.42 146.72 47.78 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.654 0.782 . . . . 0.0 110.077 -178.574 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 37.5 m -87.04 114.88 24.03 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.673 0.789 . . . . 0.0 109.432 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -87.3 100.17 12.51 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.992 0.917 . . . . 0.0 111.769 -174.052 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -144.09 15.57 1.71 Allowed 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.485 0.714 . . . . 0.0 111.608 -175.531 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.758 ' HB2' HD11 ' A' ' 58' ' ' LEU . 3.5 mp0 -57.94 119.16 6.25 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.367 0.667 . . . . 0.0 109.875 -175.719 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 22.9 t -72.14 -11.6 15.1 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 123.992 0.917 . . . . 0.0 111.65 -169.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 63.9 tp -54.49 123.84 14.29 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 123.612 0.765 . . . . 0.0 111.434 176.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -71.77 -17.0 62.21 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.564 0.745 . . . . 0.0 111.717 -177.083 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -79.9 13.18 2.3 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.247 0.619 . . . . 0.0 112.666 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.758 HD11 ' HB2' ' A' ' 53' ' ' GLU . 18.2 mt -89.15 132.11 34.97 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 161.026 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -64.08 129.84 38.26 Favored Glycine 0 C--N 1.347 1.161 0 CA-C-O 119.244 -0.753 . . . . 0.0 111.483 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -63.84 -40.82 97.49 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.853 0.861 . . . . 0.0 112.235 -175.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 62.3 t -57.53 -39.23 68.07 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 C-N-CA 123.688 0.795 . . . . 0.0 109.518 173.178 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.544 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -63.87 -57.36 14.37 Favored Glycine 0 C--N 1.344 1.021 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.427 177.665 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -58.48 -42.86 88.51 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 124.966 1.306 . . . . 0.0 112.109 -175.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -70.19 -50.9 35.47 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.24 -173.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -62.78 -37.58 87.25 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.421 178.113 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.686 HD22 HD21 ' A' ' 27' ' ' LEU . 10.4 tp -58.27 -49.53 76.79 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.951 1.301 . . . . 0.0 109.963 178.368 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -66.74 -33.83 76.5 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.925 -176.078 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.34 -35.02 75.49 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.522 0.729 . . . . 0.0 110.571 175.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.526 HG21 ' HB2' ' A' ' 20' ' ' GLN . 97.3 mt -68.36 -54.21 23.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 123.731 0.813 . . . . 0.0 110.314 176.526 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -59.53 -32.14 70.04 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 124.918 1.287 . . . . 0.0 112.11 178.095 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.477 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -65.14 -46.61 80.24 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.303 0.641 . . . . 0.0 109.647 174.142 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.468 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -69.01 -36.18 77.5 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.702 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.576 HD23 HD12 ' A' ' 76' ' ' ILE . 73.8 mt -71.2 -34.06 70.52 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 124.165 0.986 . . . . 0.0 110.163 177.605 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.85 -36.77 85.01 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.131 173.341 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.477 ' HG2' ' O ' ' A' ' 71' ' ' ALA . 4.9 mmp_? -67.5 -35.96 80.14 Favored 'General case' 0 C--O 1.216 -0.707 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.839 175.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.576 HD12 HD23 ' A' ' 73' ' ' LEU . 64.7 mt -68.47 -43.34 83.97 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 CA-C-O 121.031 0.443 . . . . 0.0 110.385 179.004 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.7 -28.71 68.65 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.22 177.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.5 t -87.54 -15.9 36.17 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.786 0.834 . . . . 0.0 111.321 175.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 82.22 5.64 89.46 Favored Glycine 0 C--N 1.35 1.333 0 C-N-CA 123.187 0.422 . . . . 0.0 113.992 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.434 HG23 ' HD3' ' A' ' 75' ' ' ARG . 13.3 t -109.89 30.07 7.04 Favored 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 124.369 1.067 . . . . 0.0 110.538 -177.053 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.453 ' HE1' ' HB1' ' A' ' 72' ' ' ALA . 79.7 t80 -63.99 147.68 51.46 Favored 'General case' 0 N--CA 1.479 0.981 0 O-C-N 121.958 -0.464 . . . . 0.0 111.38 171.054 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 71.07 42.57 58.71 Favored Glycine 0 C--N 1.347 1.184 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.263 -175.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 98.0 m -129.61 122.28 28.77 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.34 1.056 . . . . 0.0 110.152 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.451 ' HB2' ' HB3' ' A' ' 105' ' ' CYS . 47.3 t -76.49 100.12 5.15 Favored 'General case' 0 C--N 1.351 0.649 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 170.513 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 35.4 m -60.38 -29.06 43.51 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 O-C-N 124.318 1.011 . . . . 0.0 111.628 177.645 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.503 ' HD3' ' SG ' ' A' ' 108' ' ' CYS . 47.6 tttm -77.23 -6.28 52.48 Favored 'General case' 0 CA--C 1.56 1.351 0 C-N-CA 124.296 1.038 . . . . 0.0 111.665 -177.392 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 63.1 m -124.26 -33.96 2.99 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.981 0.913 . . . . 0.0 112.37 177.327 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 87.31 6.5 78.0 Favored Glycine 0 CA--C 1.537 1.415 0 N-CA-C 111.874 -0.49 . . . . 0.0 111.874 -160.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -96.34 -172.21 2.47 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.379 1.071 . . . . 0.0 111.233 -174.181 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 26.6 mmt85 -91.45 163.05 14.31 Favored 'General case' 0 C--O 1.244 0.791 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.467 169.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 20.1 mm -92.45 142.95 12.36 Favored 'Isoleucine or valine' 0 C--O 1.244 0.767 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 163.234 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 44.2 m -68.29 144.16 54.95 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 175.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -61.02 -36.45 79.55 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 122.625 0.37 . . . . 0.0 110.169 174.242 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -59.15 -40.88 86.92 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.304 1.042 . . . . 0.0 110.332 175.379 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.414 ' HE ' ' HA ' ' A' ' 95' ' ' ARG . 0.2 OUTLIER -71.37 -38.16 71.57 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.559 177.056 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 73.2 mt -70.44 -35.42 73.36 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.613 0.765 . . . . 0.0 112.031 -177.035 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -79.24 -27.45 42.41 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.128 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -78.97 -27.88 43.54 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.004 0.922 . . . . 0.0 111.231 174.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.9 p -170.86 99.3 0.42 Allowed Pre-proline 0 CA--C 1.561 1.367 0 C-N-CA 124.937 1.295 . . . . 0.0 109.212 -178.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -75.55 -12.59 20.45 Favored 'Trans proline' 0 C--N 1.375 1.924 0 C-N-CA 122.366 2.044 . . . . 0.0 112.675 176.662 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 12.6 p90 -101.86 57.89 0.83 Allowed 'General case' 0 C--O 1.24 0.587 0 C-N-CA 124.215 1.006 . . . . 0.0 109.599 -179.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 11.9 t -131.88 117.26 16.09 Favored Pre-proline 0 CA--C 1.552 1.057 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.876 174.223 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -77.4 -4.77 15.05 Favored 'Trans proline' 0 C--N 1.375 1.923 0 C-N-CA 122.65 2.233 . . . . 0.0 112.134 171.411 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.449 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 16.2 m-85 -116.02 138.5 51.16 Favored 'General case' 0 C--N 1.353 0.753 0 C-N-CA 123.932 0.893 . . . . 0.0 110.369 -173.688 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.494 ' SG ' ' HB2' ' A' ' 107' ' ' GLU . 22.0 p -72.64 168.97 17.57 Favored 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 174.157 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -52.94 -37.75 61.27 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.802 0.841 . . . . 0.0 111.861 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.494 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 24.8 mt-10 -54.82 -53.47 54.77 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 124.211 1.004 . . . . 0.0 110.63 176.522 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.503 ' SG ' ' HD3' ' A' ' 86' ' ' LYS . 87.8 m -71.39 -38.59 71.48 Favored 'General case' 0 C--O 1.214 -0.775 0 CA-C-N 114.563 -1.199 . . . . 0.0 111.28 -176.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.95 -21.35 66.82 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.35 0.66 . . . . 0.0 111.216 176.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -85.07 -31.41 23.4 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.493 0.717 . . . . 0.0 111.291 172.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -133.31 81.48 1.93 Allowed 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.517 0.727 . . . . 0.0 111.28 -176.278 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 97.9 mt . . . . . 0 N--CA 1.484 1.233 0 C-N-CA 123.764 0.825 . . . . 0.0 109.383 171.876 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.3 mp . . . . . 0 N--CA 1.484 1.241 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -150.21 148.68 29.21 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.682 0.793 . . . . 0.0 109.913 179.48 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -174.72 -147.98 6.42 Favored Glycine 0 C--N 1.341 0.823 0 N-CA-C 111.772 -0.531 . . . . 0.0 111.772 -178.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.8 -26.08 72.27 Favored Glycine 0 C--N 1.351 1.377 0 C-N-CA 122.892 0.282 . . . . 0.0 113.32 -178.639 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -97.49 -67.81 0.83 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.648 0.779 . . . . 0.0 109.714 178.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 54.9 m -72.76 98.78 2.47 Favored 'General case' 0 C--N 1.349 0.552 0 C-N-CA 123.429 0.692 . . . . 0.0 110.04 -177.902 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 25.5 ptm -62.74 -40.05 96.01 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 123.205 0.602 . . . . 0.0 109.387 171.756 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.3 t30 52.49 101.35 0.01 OUTLIER 'General case' 0 C--N 1.357 0.894 0 C-N-CA 126.24 1.816 . . . . 0.0 111.555 -178.697 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 39.8 t -61.32 -26.94 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.407 178.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -62.63 -40.54 97.3 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 124.305 1.042 . . . . 0.0 110.691 175.733 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.5 m -59.27 -44.18 92.46 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 121.052 0.453 . . . . 0.0 110.406 175.575 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -71.38 -32.5 68.54 Favored 'General case' 0 C--N 1.347 0.494 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.738 -179.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -62.49 -57.0 12.76 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.182 0.993 . . . . 0.0 109.292 -179.457 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 18.2 ptmt -66.76 -39.28 87.82 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 123.899 0.75 . . . . 0.0 112.404 -174.37 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 14.0 tt -63.37 -34.37 66.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 -179.455 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.509 ' HB3' HG23 ' A' ' 69' ' ' ILE . 80.4 mt -70.61 -33.67 71.29 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 122.927 0.491 . . . . 0.0 111.843 175.577 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.02 -46.24 85.35 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 122.964 0.505 . . . . 0.0 109.733 176.383 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -60.95 -49.94 75.43 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.775 0.83 . . . . 0.0 111.062 176.208 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.462 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 3.5 mpt_? -66.0 -37.3 85.57 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 115.168 -0.923 . . . . 0.0 111.778 -174.807 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.615 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.5 pt20 -70.72 -40.64 72.7 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 117.996 0.362 . . . . 0.0 110.389 -177.667 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.43 ' HD2' ' HD3' ' A' ' 45' ' ' ARG . 91.5 mtt-85 -79.39 -30.31 42.42 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 112.427 0.528 . . . . 0.0 112.427 -175.076 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -68.4 -31.06 70.15 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 172.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.492 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 97.7 mt -66.89 -51.34 56.58 Favored 'General case' 0 C--N 1.352 0.709 0 CA-C-O 119.113 -0.47 . . . . 0.0 110.232 170.326 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -49.83 -51.67 38.18 Favored 'General case' 0 N--CA 1.483 1.209 0 O-C-N 124.303 1.002 . . . . 0.0 111.923 -177.213 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.421 ' HB2' ' O ' ' A' ' 34' ' ' PHE . 7.3 ptp85 -64.63 -38.66 91.77 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 123.306 0.379 . . . . 0.0 111.248 177.131 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -65.16 -33.53 76.24 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.581 0.752 . . . . 0.0 112.322 -177.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 4.1 pp -103.39 -17.03 15.43 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -175.554 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 71.4 m-70 -87.62 18.27 4.09 Favored 'General case' 0 N--CA 1.486 1.33 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 167.353 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -47.87 -32.49 6.27 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 126.341 1.856 . . . . 0.0 114.23 176.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.551 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.1 OUTLIER -67.68 -26.97 36.53 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.227 0 C-N-CA 124.334 1.054 . . . . 0.0 112.65 -177.381 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -116.3 -17.4 10.76 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.821 0.848 . . . . 0.0 111.117 -179.038 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -122.87 124.01 42.28 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.169 0.987 . . . . 0.0 109.628 -173.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -89.67 12.6 16.41 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.582 0.753 . . . . 0.0 110.934 177.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.421 ' O ' ' HB2' ' A' ' 25' ' ' ARG . 86.8 m-85 -97.11 99.69 11.18 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 124.606 1.163 . . . . 0.0 109.768 -172.567 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -105.35 -44.3 4.76 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.531 0.733 . . . . 0.0 109.766 175.184 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 65.86 167.77 0.11 Allowed Pre-proline 0 CA--C 1.572 1.79 0 C-N-CA 124.26 1.024 . . . . 0.0 111.816 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.505 ' HD2' ' HB2' ' A' ' 41' ' ' ASP . 53.3 Cg_exo -57.72 -165.02 0.02 OUTLIER 'Trans proline' 0 C--N 1.388 2.645 0 C-N-CA 123.286 2.657 . . . . 0.0 115.107 172.833 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 39.1 mmt180 -65.18 -37.73 88.27 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.283 0.633 . . . . 0.0 110.611 174.254 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -79.15 150.08 73.92 Favored Pre-proline 0 CA--C 1.548 0.883 0 CA-C-N 115.078 -0.965 . . . . 0.0 108.735 168.64 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -62.75 -22.85 74.28 Favored 'Trans proline' 0 C--N 1.379 2.139 0 C-N-CA 122.399 2.066 . . . . 0.0 112.987 -176.361 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.505 ' HB2' ' HD2' ' A' ' 37' ' ' PRO . 24.6 t70 77.1 -51.15 0.56 Allowed 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 125.923 1.689 . . . . 0.0 112.736 174.335 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -52.29 118.11 3.3 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.186 0.995 . . . . 0.0 110.765 177.604 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -59.06 -58.22 9.61 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.524 0.73 . . . . 0.0 110.355 -174.433 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -84.3 144.19 29.04 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 165.446 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.43 ' HD3' ' HD2' ' A' ' 21' ' ' ARG . 59.3 ttm-85 -66.96 86.85 0.14 Allowed 'General case' 0 CA--C 1.553 1.083 0 O-C-N 124.084 0.865 . . . . 0.0 111.05 -174.643 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.05 122.79 24.08 Favored 'General case' 0 C--O 1.244 0.765 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.878 -175.171 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 40.2 m -143.22 -71.82 0.3 Allowed 'General case' 0 C--O 1.244 0.773 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 176.769 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 53.36 -168.59 0.05 Allowed 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 124.211 1.004 . . . . 0.0 111.172 -170.408 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 11.8 mtm-85 61.07 -170.01 0.16 Allowed 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.295 0.638 . . . . 0.0 111.974 173.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.4 p -170.9 -52.24 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.844 0.857 . . . . 0.0 109.171 174.002 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 66.43 108.5 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.538 1.535 . . . . 0.0 111.157 178.063 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -69.6 -34.83 74.67 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.45 0.7 . . . . 0.0 110.84 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -63.05 123.98 19.96 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 123.565 0.541 . . . . 0.0 110.482 -179.452 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 98.9 t -66.16 -47.13 85.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 O-C-N 123.864 0.728 . . . . 0.0 109.762 -178.517 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 35.8 tp 67.1 117.62 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 125.105 1.362 . . . . 0.0 111.773 175.503 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -72.19 -15.94 61.96 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.593 0.757 . . . . 0.0 112.05 -175.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -71.25 -85.41 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 122.528 0.331 . . . . 0.0 110.2 178.676 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.437 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 59.3 mt 31.06 -89.21 0.0 OUTLIER 'General case' 0 CA--C 1.558 1.267 0 C-N-CA 126.388 1.875 . . . . 0.0 114.423 -172.505 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 159.41 101.69 0.17 Allowed Glycine 0 C--N 1.342 0.91 0 N-CA-C 110.149 -1.18 . . . . 0.0 110.149 -172.029 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -48.16 -53.33 17.15 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 124.552 1.141 . . . . 0.0 113.363 -168.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.48 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 95.1 t -57.59 -44.1 84.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 O-C-N 124.061 0.851 . . . . 0.0 110.425 -179.353 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -67.97 -33.36 79.14 Favored Glycine 0 C--N 1.347 1.179 0 O-C-N 123.98 0.8 . . . . 0.0 113.394 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -72.08 -43.67 64.47 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.521 0.728 . . . . 0.0 110.62 -179.561 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -70.22 -35.73 74.06 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.867 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.48 ' HB2' ' O ' ' A' ' 61' ' ' VAL . 2.1 tp10 -66.39 -47.56 72.92 Favored 'General case' 0 C--N 1.349 0.554 0 CA-C-N 114.866 -1.061 . . . . 0.0 109.145 179.362 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 10.5 mt -51.33 -46.82 62.77 Favored 'General case' 0 N--CA 1.482 1.134 0 O-C-N 124.544 1.153 . . . . 0.0 110.999 173.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -64.01 -36.77 85.08 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.644 -176.113 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -74.76 -33.71 62.36 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.843 0.857 . . . . 0.0 111.469 177.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.615 HG21 ' HB3' ' A' ' 20' ' ' GLN . 69.9 mt -69.16 -55.85 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.782 0.833 . . . . 0.0 110.078 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -66.59 -21.91 66.13 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.567 1.147 . . . . 0.0 112.221 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.82 -49.81 71.4 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 121.275 0.559 . . . . 0.0 109.818 170.091 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.467 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -66.59 -41.51 88.37 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.244 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.433 HD21 ' HB2' ' A' ' 16' ' ' LEU . 79.6 mt -63.36 -41.26 98.82 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 124.386 1.074 . . . . 0.0 111.707 178.669 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.18 -40.17 84.81 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.762 0.825 . . . . 0.0 110.347 174.526 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 79.5 mtt85 -76.07 -23.11 55.01 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 115.087 -0.96 . . . . 0.0 112.731 -179.579 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 72' ' ' ALA . 85.3 mt -71.68 -44.34 69.45 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 173.721 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.42 -33.13 75.02 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.753 176.792 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 26.0 t -83.17 -19.35 36.75 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.67 0.788 . . . . 0.0 111.279 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 84.83 10.26 79.34 Favored Glycine 0 C--N 1.349 1.281 0 C-N-CA 122.924 0.297 . . . . 0.0 113.747 179.589 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.7 t -113.84 30.81 6.98 Favored 'General case' 0 CA--C 1.558 1.269 0 C-N-CA 123.92 0.888 . . . . 0.0 110.441 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -67.37 147.29 53.12 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 122.014 -0.429 . . . . 0.0 110.41 171.476 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.484 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 74.61 44.61 25.77 Favored Glycine 0 C--N 1.345 1.068 0 O-C-N 123.551 0.532 . . . . 0.0 111.823 -177.869 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 85.5 m -123.13 123.01 39.86 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.7 0.8 . . . . 0.0 110.366 179.483 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 22.4 t -70.34 89.51 0.67 Allowed 'General case' 0 C--N 1.353 0.735 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 170.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 15.2 m -63.56 -30.27 49.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.832 0.853 . . . . 0.0 112.3 -169.384 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 57.1 tttm -69.23 -20.2 63.95 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.203 1.001 . . . . 0.0 111.128 179.697 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 7.0 m -119.49 -16.47 8.9 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.089 0.955 . . . . 0.0 111.386 -173.603 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 65.54 21.6 68.97 Favored Glycine 0 CA--C 1.539 1.562 0 C-N-CA 122.937 0.303 . . . . 0.0 112.956 -168.148 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -104.35 -170.2 1.73 Allowed 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.582 1.153 . . . . 0.0 110.987 -174.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.484 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 13.2 tpp180 -91.7 154.88 18.69 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.347 1.059 . . . . 0.0 110.494 178.963 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 31.8 mm -98.05 149.34 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 168.01 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.7 m -73.97 145.43 44.65 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.833 0.853 . . . . 0.0 109.526 175.121 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.424 ' HG2' ' HZ3' ' A' ' 97' ' ' LYS . 33.5 tt0 -62.63 -30.84 71.66 Favored 'General case' 0 N--CA 1.482 1.125 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 174.596 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.528 ' HA ' ' HE2' ' A' ' 97' ' ' LYS . 17.7 m-20 -62.36 -41.75 98.85 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.297 1.039 . . . . 0.0 111.295 175.536 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.435 ' HG3' HG21 ' A' ' 102' ' ' THR . 21.9 tpt180 -68.71 -40.55 79.91 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.1 176.766 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 94.4 mt -71.44 -32.24 68.11 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.152 0.581 . . . . 0.0 112.41 -177.141 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.528 ' HE2' ' HA ' ' A' ' 94' ' ' ASP . 0.2 OUTLIER -78.13 -32.2 50.29 Favored 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -179.502 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.37 -41.33 56.63 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.003 0.921 . . . . 0.0 110.737 176.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.4 p -153.45 98.48 2.7 Favored Pre-proline 0 CA--C 1.556 1.175 0 C-N-CA 124.906 1.282 . . . . 0.0 108.803 -176.424 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_exo -68.73 -24.93 34.26 Favored 'Trans proline' 0 C--N 1.371 1.756 0 C-N-CA 122.584 2.189 . . . . 0.0 112.28 173.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 9.1 p90 -89.53 58.63 4.43 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.652 1.181 . . . . 0.0 109.988 -178.73 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.435 HG21 ' HG3' ' A' ' 95' ' ' ARG . 10.9 t -123.83 104.15 33.44 Favored Pre-proline 0 CA--C 1.559 1.294 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.684 -175.143 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -67.35 -36.63 20.09 Favored 'Trans proline' 0 C--N 1.378 2.126 0 C-N-CA 122.474 2.116 . . . . 0.0 111.839 174.191 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -99.69 174.73 6.09 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -178.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.555 ' SG ' ' HB2' ' A' ' 108' ' ' CYS . 24.9 p -98.38 179.09 4.83 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.343 0.657 . . . . 0.0 109.301 176.243 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -54.52 -56.88 14.34 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.739 0.816 . . . . 0.0 111.768 -179.46 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -69.32 -39.67 78.07 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.933 -176.272 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.555 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 80.6 m -78.66 -21.8 47.76 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -176.075 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -76.21 -33.12 59.26 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 171.514 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.87 -23.12 59.55 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.648 172.283 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ALA . . . . . 0.439 ' HB3' ' HA ' ' A' ' 108' ' ' CYS . . . -102.42 18.69 20.47 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.28 1.032 . . . . 0.0 112.048 -176.761 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 82.5 mt . . . . . 0 N--CA 1.482 1.141 0 C-N-CA 122.907 0.483 . . . . 0.0 110.478 175.255 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.5 mp . . . . . 0 N--CA 1.481 1.109 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -155.09 116.73 4.07 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.485 0.714 . . . . 0.0 110.197 175.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 138.77 -126.4 3.4 Favored Glycine 0 C--N 1.346 1.09 0 N-CA-C 110.986 -0.846 . . . . 0.0 110.986 178.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 75.37 -81.66 0.94 Allowed Glycine 0 C--N 1.348 1.238 0 N-CA-C 111.693 -0.563 . . . . 0.0 111.693 178.166 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -96.32 -12.55 24.28 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.977 0.911 . . . . 0.0 110.802 176.512 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 66.8 m -104.19 169.02 8.73 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.498 0.719 . . . . 0.0 109.412 170.17 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 61.4 ttp -63.03 120.93 12.36 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 178.085 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -75.66 72.07 2.59 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.056 0.942 . . . . 0.0 111.845 -174.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 21.9 t -70.7 -29.1 36.58 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 CA-C-N 115.344 -0.844 . . . . 0.0 109.791 176.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -68.77 -38.07 79.8 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.668 0.787 . . . . 0.0 111.183 178.592 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 27.8 m -63.45 -37.99 89.43 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.815 174.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.413 ' HA ' HG22 ' A' ' 15' ' ' ILE . 21.0 m-85 -70.8 -34.22 71.52 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.861 175.665 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.495 ' HG2' HG21 ' A' ' 76' ' ' ILE . 4.7 mm-40 -55.42 -59.23 5.1 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 124.107 0.963 . . . . 0.0 109.963 178.749 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.2 ptmt -66.82 -45.64 77.67 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.858 -174.234 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.51 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 12.3 tt -64.3 -36.04 75.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 CA-C-N 117.861 0.301 . . . . 0.0 110.624 -174.354 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.596 ' HB3' HG23 ' A' ' 69' ' ' ILE . 63.1 mt -66.67 -38.08 86.08 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.227 0.611 . . . . 0.0 110.82 176.597 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.45 ' HA ' ' HG2' ' A' ' 20' ' ' GLN . 96.2 mtt-85 -72.18 -26.08 61.93 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 123.513 0.508 . . . . 0.0 111.57 178.881 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 53.5 m-20 -74.2 -40.06 62.73 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 122.872 0.469 . . . . 0.0 110.305 173.699 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.51 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -67.22 -40.13 86.35 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.416 177.183 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.624 ' HB3' HG21 ' A' ' 69' ' ' ILE . 1.3 pt20 -71.37 -31.07 66.89 Favored 'General case' 0 C--O 1.204 -1.303 0 CA-C-O 118.906 -0.569 . . . . 0.0 109.691 178.652 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -56.2 -54.58 43.54 Favored 'General case' 0 N--CA 1.496 1.862 0 CA-C-N 118.618 0.645 . . . . 0.0 110.548 174.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -67.9 -35.22 78.11 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.857 -176.714 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.543 ' HA ' ' HG2' ' A' ' 26' ' ' ARG . 97.8 mt -69.11 -50.62 46.44 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 122.792 0.437 . . . . 0.0 111.396 176.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -51.24 -46.0 62.18 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 124.513 1.125 . . . . 0.0 111.026 -178.672 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.1 ptm180 -75.17 -32.61 61.32 Favored 'General case' 0 CA--C 1.549 0.923 0 O-C-N 123.428 0.455 . . . . 0.0 111.779 -179.142 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.543 ' HG2' ' HA ' ' A' ' 23' ' ' LEU . 6.3 ptm180 -74.01 -27.27 60.88 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-N 118.075 0.398 . . . . 0.0 111.417 -177.614 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.0 pp -89.56 -31.99 17.35 Favored 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 110.04 -0.355 . . . . 0.0 110.04 176.535 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 55.4 m-70 -86.02 29.78 0.71 Allowed 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.146 0.578 . . . . 0.0 110.276 169.065 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 18.3 pttp -50.61 -37.12 38.47 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 125.378 1.471 . . . . 0.0 112.619 176.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.504 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -61.55 -29.83 46.91 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.081 0 C-N-CA 124.142 0.977 . . . . 0.0 111.86 178.022 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.436 ' HG2' HG12 ' A' ' 30' ' ' ILE . 30.3 mm-40 -96.97 -29.45 13.66 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.445 1.098 . . . . 0.0 110.877 177.777 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -91.83 66.46 5.14 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 122.211 1.005 . . . . 0.0 110.803 -171.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -79.78 -16.37 55.67 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-N 114.127 -1.397 . . . . 0.0 109.218 170.085 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -60.14 114.77 3.04 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.869 1.268 . . . . 0.0 110.735 178.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.421 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 16.8 tp10 -83.93 -19.83 34.01 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.435 0.694 . . . . 0.0 111.269 -177.391 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.421 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 4.1 pt-20 66.76 155.06 0.13 Allowed Pre-proline 0 N--CA 1.493 1.723 0 C-N-CA 125.97 1.708 . . . . 0.0 111.933 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -71.45 -86.85 0.0 OUTLIER 'Trans proline' 0 C--N 1.373 1.844 0 C-N-CA 121.601 1.534 . . . . 0.0 109.543 163.213 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 64.1 mtm-85 -141.09 17.01 2.27 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 124.556 1.142 . . . . 0.0 108.912 171.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -164.07 108.81 0.91 Allowed Pre-proline 0 CA--C 1.552 1.035 0 C-N-CA 124.311 1.045 . . . . 0.0 109.471 -172.525 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -96.41 6.17 1.75 Allowed 'Trans proline' 0 C--N 1.375 1.946 0 C-N-CA 123.02 2.48 . . . . 0.0 111.893 170.181 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -166.36 115.18 0.92 Allowed 'General case' 0 C--N 1.353 0.731 0 C-N-CA 124.374 1.07 . . . . 0.0 108.935 -177.251 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -100.73 38.15 1.58 Allowed 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.025 0.93 . . . . 0.0 109.612 178.755 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 60.78 61.33 1.7 Allowed 'General case' 0 C--O 1.242 0.695 0 C-N-CA 124.141 0.977 . . . . 0.0 108.63 -170.55 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.12 -26.94 66.05 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 114.409 -1.268 . . . . 0.0 110.379 175.06 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 65.14 50.75 1.77 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.683 1.193 . . . . 0.0 108.758 178.751 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -79.96 87.72 5.37 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-N 114.399 -1.273 . . . . 0.0 108.445 171.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 16.2 p -77.4 75.7 3.95 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-O 121.833 0.825 . . . . 0.0 110.244 -178.705 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -157.8 112.12 2.6 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.147 -1.388 . . . . 0.0 108.013 -179.316 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.518 ' HD2' HD21 ' A' ' 51' ' ' ASN . 14.1 ptt180 -86.13 169.56 13.0 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.679 0.792 . . . . 0.0 110.077 179.247 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 62.0 p -150.3 50.09 0.9 Allowed 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.036 0.534 . . . . 0.0 110.339 179.123 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.518 HD21 ' HD2' ' A' ' 49' ' ' ARG . 12.1 p30 -106.68 -171.17 1.84 Allowed 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 123.284 0.634 . . . . 0.0 110.013 175.526 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 35.0 t70 64.06 32.24 12.97 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 124.458 1.103 . . . . 0.0 110.194 178.81 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.4 ' HB2' HD11 ' A' ' 58' ' ' LEU . 41.7 mt-10 -90.54 142.78 27.39 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.025 -175.896 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 26.4 t -85.7 -8.33 11.11 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.263 0 C-N-CA 123.684 0.794 . . . . 0.0 110.789 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 34.8 tp -58.06 120.71 9.05 Favored 'General case' 0 C--N 1.36 1.037 0 C-N-CA 123.252 0.621 . . . . 0.0 111.29 -177.042 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -77.35 -15.56 59.33 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.73 0.812 . . . . 0.0 111.473 -177.326 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -79.91 5.95 12.48 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.354 0.662 . . . . 0.0 112.61 177.08 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.4 HD11 ' HB2' ' A' ' 53' ' ' GLU . 35.9 mt -86.16 142.67 28.47 Favored 'General case' 0 C--O 1.241 0.652 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 169.465 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -65.14 142.48 44.77 Favored Glycine 0 C--N 1.347 1.185 0 CA-C-O 119.524 -0.598 . . . . 0.0 112.309 178.267 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -58.34 -50.78 72.4 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.311 1.044 . . . . 0.0 111.286 -179.289 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 11.2 p -61.89 -33.66 59.06 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.261 177.042 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -67.23 -51.84 35.64 Favored Glycine 0 C--N 1.347 1.16 0 O-C-N 123.905 0.753 . . . . 0.0 112.443 -178.73 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -62.33 -43.87 97.82 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.06 0.944 . . . . 0.0 111.162 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -65.27 -48.04 74.6 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.973 -177.18 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -77.35 -27.38 52.69 Favored 'General case' 0 C--O 1.216 -0.669 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.83 -175.398 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.3 mp -59.72 -47.19 86.62 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-O 121.544 0.688 . . . . 0.0 109.286 169.726 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 40.0 ttt180 -60.57 -37.56 81.7 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 114.33 -1.304 . . . . 0.0 110.318 -178.669 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.33 -39.72 59.14 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.191 0.997 . . . . 0.0 111.741 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.624 HG21 ' HB3' ' A' ' 20' ' ' GLN . 67.8 mt -74.68 -57.87 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 123.713 0.805 . . . . 0.0 110.274 -177.288 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -56.2 -33.54 65.42 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.218 1.007 . . . . 0.0 111.79 177.394 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.444 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -63.53 -51.33 65.92 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 110.269 -0.271 . . . . 0.0 110.269 171.602 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.481 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -58.57 -44.78 89.87 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.942 0.897 . . . . 0.0 111.588 -177.788 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.431 HD21 ' HB2' ' A' ' 16' ' ' LEU . 95.8 mt -64.68 -38.43 90.96 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 124.745 1.218 . . . . 0.0 111.463 179.13 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.75 -33.38 74.74 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.728 176.302 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.451 ' NH1' HG11 ' A' ' 85' ' ' VAL . 79.8 mtt-85 -74.84 -25.49 59.03 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.511 0.724 . . . . 0.0 111.051 177.181 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.495 HG21 ' HG2' ' A' ' 13' ' ' GLU . 82.7 mt -70.91 -46.43 68.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 172.535 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.36 -25.79 68.19 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.861 0.864 . . . . 0.0 111.347 176.359 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.9 t -83.9 -29.57 27.07 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.941 0.896 . . . . 0.0 111.133 174.54 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 84.94 14.8 68.82 Favored Glycine 0 C--N 1.349 1.297 0 C-N-CA 123.034 0.35 . . . . 0.0 113.421 -176.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 15.3 t -106.13 7.57 31.74 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 123.809 0.844 . . . . 0.0 110.819 178.074 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -67.55 145.47 54.87 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 171.412 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.413 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 83.68 12.91 76.8 Favored Glycine 0 C--N 1.344 0.972 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.864 -171.19 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 43.4 m -130.39 119.18 22.34 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.217 1.007 . . . . 0.0 109.792 175.467 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 41.9 t -64.28 100.56 0.35 Allowed 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.9 0.88 . . . . 0.0 109.314 171.361 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.451 HG11 ' NH1' ' A' ' 75' ' ' ARG . 24.9 m -67.4 -23.61 30.34 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.918 0 C-N-CA 123.841 0.856 . . . . 0.0 111.782 -179.616 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 42.4 tttm -70.48 -17.56 62.97 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.598 0.759 . . . . 0.0 110.86 174.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 54.3 m -112.14 -29.39 7.6 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 124.295 1.038 . . . . 0.0 111.811 177.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 69.4 22.24 76.31 Favored Glycine 0 CA--C 1.539 1.58 0 CA-C-N 116.176 -0.465 . . . . 0.0 112.406 -162.374 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -126.09 174.38 8.52 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 124.674 1.19 . . . . 0.0 109.209 -174.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.413 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 13.3 tpp180 -67.04 158.23 31.53 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 124.708 1.203 . . . . 0.0 112.629 -173.677 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 13.1 mm -100.19 146.37 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 N-CA-C 107.786 -1.191 . . . . 0.0 107.786 164.319 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.7 m -72.36 140.97 48.75 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 173.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -63.72 -29.25 70.49 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 175.313 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -55.66 -49.68 72.25 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.658 1.183 . . . . 0.0 110.117 173.719 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.474 ' HG3' HG21 ' A' ' 102' ' ' THR . 26.2 tpt180 -62.19 -46.41 89.04 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 113.907 -1.497 . . . . 0.0 110.804 178.407 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 97.1 mt -66.22 -39.74 89.81 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.538 0.735 . . . . 0.0 112.087 -175.744 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -74.87 -32.03 61.76 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 122.353 0.261 . . . . 0.0 110.435 -176.221 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -79.3 -43.16 24.19 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.645 0.778 . . . . 0.0 111.192 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.1 p -148.2 95.32 4.12 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 124.724 1.21 . . . . 0.0 108.473 -177.782 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -79.64 -6.5 14.44 Favored 'Trans proline' 0 C--N 1.371 1.714 0 C-N-CA 122.382 2.055 . . . . 0.0 113.579 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 20.0 p90 -95.54 47.83 1.13 Allowed 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 121.732 0.777 . . . . 0.0 110.282 177.491 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.474 HG21 ' HG3' ' A' ' 95' ' ' ARG . 13.3 t -125.75 111.11 25.13 Favored Pre-proline 0 CA--C 1.559 1.302 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.241 178.765 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo -74.91 -13.48 21.63 Favored 'Trans proline' 0 C--N 1.369 1.651 0 C-N-CA 122.552 2.168 . . . . 0.0 111.834 169.275 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.415 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 10.8 m-85 -104.4 156.76 17.66 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.425 1.09 . . . . 0.0 110.331 -176.127 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 30.6 p -83.8 171.1 13.45 Favored 'General case' 0 N--CA 1.481 1.113 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 172.671 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -59.8 -35.55 74.91 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.46 0.704 . . . . 0.0 111.057 -176.017 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -58.03 -54.41 47.29 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 114.902 -1.045 . . . . 0.0 110.738 173.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.415 ' HB2' ' HB3' ' A' ' 104' ' ' PHE . 79.9 m -64.91 -35.8 82.3 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 123.885 0.741 . . . . 0.0 111.485 -178.544 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -63.72 -45.28 90.65 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.889 0.875 . . . . 0.0 110.258 -179.422 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.67 -20.39 61.25 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.344 177.514 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -98.37 8.8 44.36 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.006 0.922 . . . . 0.0 112.227 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 89.3 mt . . . . . 0 N--CA 1.482 1.164 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 173.49 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 8.0 mp . . . . . 0 N--CA 1.482 1.15 0 N-CA-C 110.232 -0.285 . . . . 0.0 110.232 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 68.43 17.52 9.13 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 125.145 1.378 . . . . 0.0 112.995 179.285 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 73.96 -84.61 0.69 Allowed Glycine 0 C--N 1.349 1.268 0 CA-C-O 119.821 -0.433 . . . . 0.0 113.358 178.283 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 74.67 -112.48 3.72 Favored Glycine 0 C--N 1.349 1.287 0 N-CA-C 112.241 -0.344 . . . . 0.0 112.241 -178.551 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -78.65 172.48 13.64 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 122.931 0.493 . . . . 0.0 109.858 171.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.9 t 64.84 29.89 12.39 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.249 1.02 . . . . 0.0 109.904 -175.602 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 55.2 ttp -64.34 119.14 9.76 Favored 'General case' 0 C--N 1.353 0.745 0 CA-C-N 115.074 -0.966 . . . . 0.0 108.725 172.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -76.1 72.28 2.9 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.219 0.608 . . . . 0.0 111.408 -173.694 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 59.3 t -62.85 -36.04 73.76 Favored 'Isoleucine or valine' 0 C--N 1.351 0.671 0 C-N-CA 123.629 0.772 . . . . 0.0 110.342 -178.488 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -60.77 -38.81 86.53 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.962 0.905 . . . . 0.0 111.948 -179.86 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 28.5 m -64.92 -44.34 89.83 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.505 0.722 . . . . 0.0 110.004 175.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.404 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 29.4 m-85 -69.47 -32.55 71.53 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.143 179.198 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -64.55 -54.92 24.54 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.438 1.095 . . . . 0.0 109.632 -176.167 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.01 -38.76 89.26 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.733 -176.679 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 12.6 tt -69.66 -31.36 48.43 Favored 'Isoleucine or valine' 0 C--N 1.362 1.113 0 N-CA-C 110.29 -0.263 . . . . 0.0 110.29 -179.176 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.555 ' HB3' HG23 ' A' ' 69' ' ' ILE . 55.3 mt -70.96 -38.51 72.79 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.273 0.629 . . . . 0.0 111.147 176.262 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.47 ' O ' ' HG3' ' A' ' 21' ' ' ARG . 1.3 mmp_? -59.63 -46.76 88.04 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 123.694 0.621 . . . . 0.0 110.049 176.009 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.494 ' HA ' ' HD2' ' A' ' 21' ' ' ARG . 3.8 m-20 -73.25 -32.9 64.98 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -69.04 -40.14 78.76 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 122.8 0.44 . . . . 0.0 110.639 179.411 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.642 ' HB3' HG21 ' A' ' 69' ' ' ILE . 3.5 pt20 -72.46 -31.38 65.38 Favored 'General case' 0 C--O 1.2 -1.54 0 CA-C-O 118.594 -0.717 . . . . 0.0 109.715 176.918 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.494 ' HD2' ' HA ' ' A' ' 18' ' ' ASP . 65.4 mtt-85 -58.49 -48.89 79.31 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-N 118.583 0.628 . . . . 0.0 111.276 178.551 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -70.58 -32.88 70.43 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.341 -178.031 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.478 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 96.6 mt -76.93 -34.02 57.68 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 122.724 0.41 . . . . 0.0 111.943 176.328 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -67.01 -51.13 58.74 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.954 0.901 . . . . 0.0 108.815 179.583 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.6 ptp180 -62.78 -32.13 73.24 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.538 0.735 . . . . 0.0 110.302 -179.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -60.79 -46.64 89.72 Favored 'General case' 0 C--N 1.363 1.174 0 C-N-CA 123.656 0.782 . . . . 0.0 111.782 176.518 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.567 ' HB2' ' HA ' ' A' ' 58' ' ' LEU . 2.7 pp -96.85 -0.37 47.95 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -177.741 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -116.31 25.93 10.29 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.895 0.878 . . . . 0.0 109.993 172.479 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.3 pttp -56.95 -30.8 64.38 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 124.699 1.2 . . . . 0.0 113.229 178.772 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.559 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -65.32 -37.94 81.35 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 124.304 1.042 . . . . 0.0 112.546 179.351 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -102.77 -15.67 16.2 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.747 0.819 . . . . 0.0 111.308 -174.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -121.91 96.62 5.13 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.154 0.982 . . . . 0.0 109.4 -178.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -90.0 86.33 6.57 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -137.17 98.76 3.81 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -66.48 -45.46 79.58 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 121.886 0.851 . . . . 0.0 110.045 178.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -127.99 91.78 43.87 Favored Pre-proline 0 CA--C 1.54 0.59 0 N-CA-C 106.989 -1.485 . . . . 0.0 106.989 174.238 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -65.81 80.72 0.26 Allowed 'Trans proline' 0 C--N 1.375 1.939 0 C-N-CA 123.246 2.63 . . . . 0.0 111.776 178.817 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 90.8 mtt180 -107.13 118.75 37.54 Favored 'General case' 0 C--O 1.239 0.536 0 C-N-CA 123.897 0.879 . . . . 0.0 109.107 -178.723 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 26.3 p-10 -160.86 154.65 18.84 Favored Pre-proline 0 CA--C 1.545 0.782 0 C-N-CA 124.308 1.043 . . . . 0.0 109.371 179.122 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -58.81 -46.94 20.37 Favored 'Trans proline' 0 C--N 1.376 2.004 0 C-N-CA 122.614 2.209 . . . . 0.0 111.65 173.045 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.5 t70 63.27 87.69 0.1 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.084 1.354 . . . . 0.0 111.563 175.195 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -139.77 85.76 2.06 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.839 0.855 . . . . 0.0 108.777 176.524 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -172.72 -102.45 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.538 1.135 . . . . 0.0 108.081 173.689 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 36.1 t70 167.12 149.25 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 126.179 1.792 . . . . 0.0 107.897 -178.525 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.431 ' HA ' ' HD2' ' A' ' 45' ' ' ARG . 12.7 tpt180 -132.55 66.26 1.56 Allowed 'General case' 0 C--O 1.244 0.79 0 CA-C-O 121.912 0.863 . . . . 0.0 110.313 176.156 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.63 102.44 7.99 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 163.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 38.0 m -66.64 142.35 57.49 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.236 0.614 . . . . 0.0 110.907 -174.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 18.6 mp0 -74.01 89.96 1.96 Allowed 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.991 0.916 . . . . 0.0 109.487 -174.098 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.1 mpt_? 66.41 118.39 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 125.035 1.334 . . . . 0.0 110.848 -175.593 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.0 m -67.74 131.54 45.75 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.706 0.802 . . . . 0.0 109.877 177.263 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -61.38 130.14 44.66 Favored 'General case' 0 C--N 1.352 0.701 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 168.633 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -80.72 50.78 1.39 Allowed 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.275 1.03 . . . . 0.0 112.493 -170.304 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 58.87 38.45 24.53 Favored 'General case' 0 C--N 1.358 0.943 0 C-N-CA 125.138 1.375 . . . . 0.0 111.002 175.37 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 62.9 t -66.49 -45.53 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 CA-C-N 114.77 -1.104 . . . . 0.0 110.424 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.43 ' HG ' ' H ' ' A' ' 57' ' ' GLU . 27.2 tp -86.71 138.15 31.87 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.375 -179.551 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -86.99 0.15 55.65 Favored 'General case' 0 CA--C 1.558 1.265 0 C-N-CA 123.798 0.839 . . . . 0.0 111.924 -174.673 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.43 ' H ' ' HG ' ' A' ' 55' ' ' LEU . 34.7 mm-40 -65.26 -18.87 65.66 Favored 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 123.257 0.623 . . . . 0.0 112.359 175.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.567 ' HA ' ' HB2' ' A' ' 27' ' ' LEU . 6.4 mp -78.27 108.58 11.71 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.243 173.173 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -76.99 143.47 28.8 Favored Glycine 0 N--CA 1.471 0.988 0 CA-C-O 118.502 -1.165 . . . . 0.0 110.992 179.131 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -51.81 -52.56 48.23 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 124.348 1.059 . . . . 0.0 112.546 -171.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.456 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 7.5 p -53.6 -39.12 36.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 O-C-N 123.841 0.713 . . . . 0.0 111.761 177.124 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.423 ' O ' HD13 ' A' ' 66' ' ' LEU . . . -68.59 -43.28 77.41 Favored Glycine 0 C--N 1.345 1.069 0 O-C-N 123.616 0.573 . . . . 0.0 112.152 177.285 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -67.26 -41.57 85.32 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.637 0.775 . . . . 0.0 110.997 -175.281 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -74.74 -28.23 60.69 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 124.094 0.871 . . . . 0.0 111.239 179.619 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.456 ' HB2' ' O ' ' A' ' 61' ' ' VAL . 0.5 OUTLIER -71.73 -44.86 63.4 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 177.63 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.423 HD13 ' O ' ' A' ' 62' ' ' GLY . 5.8 mp -57.0 -47.83 79.9 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.759 1.224 . . . . 0.0 110.171 170.416 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -61.47 -37.21 82.78 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.132 0.973 . . . . 0.0 110.834 -176.272 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.67 -40.97 65.88 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.064 0.946 . . . . 0.0 111.021 177.791 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.642 HG21 ' HB3' ' A' ' 20' ' ' GLN . 83.3 mt -66.29 -53.33 37.65 Favored 'Isoleucine or valine' 0 C--N 1.356 0.857 0 C-N-CA 123.493 0.717 . . . . 0.0 110.804 -179.205 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -65.35 -27.28 68.47 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.943 0.897 . . . . 0.0 111.925 178.283 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.3 -37.02 77.59 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 122.686 0.394 . . . . 0.0 110.326 172.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.518 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -69.62 -41.71 75.32 Favored 'General case' 0 C--N 1.348 0.507 0 C-N-CA 123.368 0.667 . . . . 0.0 110.644 176.919 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.532 HD23 HD12 ' A' ' 76' ' ' ILE . 86.5 mt -68.02 -32.55 73.0 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.181 0.993 . . . . 0.0 110.923 179.137 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.5 -38.93 85.07 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.819 0.848 . . . . 0.0 110.383 173.047 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.43 ' HE ' ' HA ' ' A' ' 72' ' ' ALA . 87.1 mtm180 -67.69 -30.53 70.07 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.979 174.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.532 HD12 HD23 ' A' ' 73' ' ' LEU . 74.2 mt -70.84 -40.85 77.1 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 175.571 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.5 -32.46 72.49 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.896 0.878 . . . . 0.0 111.526 177.239 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.491 ' HB3' HG22 ' A' ' 80' ' ' THR . 34.2 t -88.08 -22.54 24.11 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.465 0.706 . . . . 0.0 111.154 176.453 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 85.31 9.77 78.9 Favored Glycine 0 C--N 1.346 1.116 0 CA-C-N 116.594 -0.275 . . . . 0.0 113.058 -175.552 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.491 HG22 ' HB3' ' A' ' 78' ' ' SER . 15.0 t -102.97 26.4 8.21 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.221 1.008 . . . . 0.0 109.612 179.302 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 90.9 t80 -63.93 147.74 51.23 Favored 'General case' 0 C--N 1.351 0.642 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 171.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 69.56 46.39 55.33 Favored Glycine 0 C--N 1.341 0.854 0 N-CA-C 110.737 -0.945 . . . . 0.0 110.737 -172.279 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 98.7 m -129.63 116.95 19.61 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.703 0.801 . . . . 0.0 110.167 174.035 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 42.9 t -68.52 100.26 1.08 Allowed 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 166.26 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 33.7 m -62.19 -27.4 42.48 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 123.995 0.918 . . . . 0.0 112.456 -176.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.488 ' HD2' ' HB3' ' A' ' 108' ' ' CYS . 24.5 ttmm -67.21 -33.69 75.9 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.496 0.718 . . . . 0.0 110.24 174.869 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 54.7 m -86.89 -29.18 22.34 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.632 0.773 . . . . 0.0 111.149 174.638 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 66.99 22.09 72.05 Favored Glycine 0 C--N 1.342 0.894 0 CA-C-N 115.79 -0.641 . . . . 0.0 112.392 -165.2 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -138.1 173.44 11.62 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.764 0.826 . . . . 0.0 110.684 -173.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 -64.89 151.47 45.54 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.943 1.297 . . . . 0.0 114.335 -170.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 13.7 mm -90.94 150.78 3.64 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.952 0 C-N-CA 125.537 1.535 . . . . 0.0 109.131 173.474 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 31.6 m -75.97 151.95 37.13 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 175.453 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -59.16 -41.62 88.79 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.202 0.601 . . . . 0.0 111.142 -179.435 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -61.7 -39.46 91.55 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.042 0.937 . . . . 0.0 111.217 -178.357 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.535 ' HE ' HG21 ' A' ' 102' ' ' THR . 29.7 tpt180 -64.74 -42.98 94.79 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.741 176.293 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 92.1 mt -67.98 -41.6 82.1 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.362 0.665 . . . . 0.0 112.209 -176.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -71.8 -28.3 63.51 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 122.587 0.355 . . . . 0.0 110.55 -178.213 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.22 -38.3 27.21 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.54 0.736 . . . . 0.0 110.884 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.4 p -160.76 95.55 1.45 Allowed Pre-proline 0 CA--C 1.559 1.291 0 C-N-CA 124.738 1.215 . . . . 0.0 109.501 -176.108 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' PRO . . . . . 0.511 ' HG2' HD21 ' A' ' 16' ' ' LEU . 69.2 Cg_endo -77.56 -23.28 9.97 Favored 'Trans proline' 0 C--N 1.375 1.972 0 C-N-CA 122.618 2.212 . . . . 0.0 113.539 -178.838 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 32.1 p90 -80.93 -9.3 59.85 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 -174.509 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.535 HG21 ' HE ' ' A' ' 95' ' ' ARG . 12.4 t -64.87 125.99 90.14 Favored Pre-proline 0 CA--C 1.565 1.527 0 CA-C-N 117.731 0.242 . . . . 0.0 111.187 -176.199 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -75.83 -12.93 19.89 Favored 'Trans proline' 0 C--N 1.375 1.931 0 C-N-CA 122.62 2.213 . . . . 0.0 112.627 174.85 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -121.68 157.11 31.6 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.608 0.763 . . . . 0.0 110.161 -176.268 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.48 ' SG ' ' OE1' ' A' ' 107' ' ' GLU . 29.3 p -86.02 165.21 16.86 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 175.607 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -46.39 -44.16 16.89 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 124.886 1.274 . . . . 0.0 114.35 -160.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.48 ' OE1' ' SG ' ' A' ' 105' ' ' CYS . 0.0 OUTLIER -84.04 -26.86 28.76 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 122.215 -0.303 . . . . 0.0 110.787 -176.286 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.488 ' HB3' ' HD2' ' A' ' 86' ' ' LYS . 95.7 m -69.86 -26.45 64.21 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.961 0.904 . . . . 0.0 110.473 174.499 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -75.45 -36.23 60.74 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.851 0.86 . . . . 0.0 110.048 172.453 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -78.13 -8.86 58.8 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.942 173.281 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -86.11 -9.47 56.61 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.647 0.779 . . . . 0.0 111.117 174.763 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 55.1 mt . . . . . 0 CA--C 1.554 1.104 0 C-N-CA 123.127 0.571 . . . . 0.0 109.542 176.086 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.6 tt . . . . . 0 N--CA 1.482 1.126 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 66.7 165.52 0.21 Allowed 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 125.051 1.34 . . . . 0.0 112.397 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 178.3 56.39 0.07 OUTLIER Glycine 0 C--N 1.341 0.85 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.796 -178.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -80.66 72.85 2.62 Favored Glycine 0 C--N 1.342 0.893 0 CA-C-N 115.305 -0.447 . . . . 0.0 112.777 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -78.11 137.74 38.36 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.355 0.662 . . . . 0.0 109.948 176.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 19.8 m -61.77 -36.09 80.02 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.764 0.826 . . . . 0.0 112.334 -172.553 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 26.8 ptm -76.32 -22.14 55.33 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-O 119.108 -0.473 . . . . 0.0 111.213 179.136 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 11.5 m120 73.75 44.18 0.3 Allowed 'General case' 0 N--CA 1.494 1.754 0 C-N-CA 125.442 1.497 . . . . 0.0 112.47 176.421 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.5 t -50.98 -46.83 30.64 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 C-N-CA 123.571 0.748 . . . . 0.0 112.088 175.639 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -65.56 -36.01 82.53 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.515 0.726 . . . . 0.0 111.681 -176.424 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.0 m -67.11 -37.97 84.82 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.256 176.845 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -70.23 -35.5 73.88 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.272 176.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.1 tm-20 -60.71 -57.63 11.87 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.984 0.913 . . . . 0.0 109.381 -176.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.436 ' HG3' ' N ' ' A' ' 15' ' ' ILE . 12.8 ptmt -63.82 -42.11 97.73 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.592 -176.852 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.436 ' N ' ' HG3' ' A' ' 14' ' ' LYS . 15.2 tt -68.78 -29.48 43.72 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 -175.061 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.524 ' HB3' HG23 ' A' ' 69' ' ' ILE . 70.7 mt -74.01 -35.48 64.39 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.241 0.616 . . . . 0.0 110.779 174.89 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.445 ' NH2' HD13 ' A' ' 73' ' ' LEU . 1.7 mmp_? -59.98 -49.28 78.29 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 172.356 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 49.2 m-20 -64.12 -41.64 97.15 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 124.006 0.922 . . . . 0.0 110.943 -177.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -66.87 -46.02 76.29 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.68 -178.626 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.592 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.8 pt20 -67.45 -29.25 68.67 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-O 118.871 -0.585 . . . . 0.0 110.099 -179.394 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.402 ' HG2' ' O ' ' A' ' 17' ' ' ARG . 33.3 mmt180 -70.22 -46.86 63.64 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.708 0.803 . . . . 0.0 111.867 -179.301 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -68.43 -32.7 72.92 Favored 'General case' 0 N--CA 1.48 1.067 0 O-C-N 123.238 0.336 . . . . 0.0 110.542 178.353 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 97.1 mt -74.54 -33.29 62.7 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.021 174.401 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -58.89 -59.66 5.09 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.012 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 38.3 ptt180 -59.01 -37.57 77.21 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 123.719 0.637 . . . . 0.0 111.28 -178.677 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 75.5 ttt180 -57.42 -56.11 26.15 Favored 'General case' 0 C--N 1.356 0.874 0 C-N-CA 124.119 0.968 . . . . 0.0 112.046 178.026 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.426 ' O ' ' HA ' ' A' ' 58' ' ' LEU . 4.5 pp -87.85 -22.55 24.39 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -172.536 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -90.39 23.46 2.94 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 175.752 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.4 ptpp? -44.17 -34.3 1.8 Allowed 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 126.582 1.953 . . . . 0.0 113.831 179.649 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.476 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -60.76 -32.19 51.33 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.123 0 C-N-CA 124.22 1.008 . . . . 0.0 111.775 -179.811 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.436 ' HG2' HG12 ' A' ' 30' ' ' ILE . 19.2 mm-40 -97.75 -53.08 3.53 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.585 1.154 . . . . 0.0 109.553 175.453 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -78.17 95.48 4.95 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-N 114.173 -1.376 . . . . 0.0 110.561 -173.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -74.82 125.57 29.07 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 114.801 -1.091 . . . . 0.0 109.266 175.103 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 -82.7 54.8 2.78 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.893 0.877 . . . . 0.0 111.313 -177.276 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -76.71 -44.95 31.39 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.388 0.675 . . . . 0.0 109.333 173.555 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -106.74 129.59 24.18 Favored Pre-proline 0 CA--C 1.552 1.04 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.395 -178.115 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_exo -74.41 92.71 0.92 Allowed 'Trans proline' 0 C--N 1.377 2.059 0 C-N-CA 122.874 2.383 . . . . 0.0 109.517 167.508 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 16.2 mtp180 -70.82 143.95 50.95 Favored 'General case' 0 N--CA 1.478 0.962 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.586 -174.537 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -65.01 145.46 99.1 Favored Pre-proline 0 N--CA 1.478 0.949 0 C-N-CA 123.64 0.776 . . . . 0.0 110.744 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -76.95 69.17 7.08 Favored 'Trans proline' 0 C--N 1.384 2.412 0 C-N-CA 122.867 2.378 . . . . 0.0 110.518 176.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.7 t70 172.43 -43.97 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 126.059 1.744 . . . . 0.0 107.591 -171.743 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 25.5 t70 60.07 -126.89 1.1 Allowed 'General case' 0 CA--C 1.562 1.425 0 CA-C-N 113.888 -1.506 . . . . 0.0 109.438 -179.022 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -165.41 19.21 0.05 OUTLIER 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.939 0.895 . . . . 0.0 110.613 179.612 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -109.3 100.17 9.32 Favored 'General case' 0 C--O 1.24 0.577 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -74.14 -29.34 61.76 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.163 178.299 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.5 78.39 1.44 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.586 0.754 . . . . 0.0 110.48 -179.05 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.5 m -94.24 82.09 4.09 Favored 'General case' 0 C--O 1.241 0.643 0 C-N-CA 123.743 0.817 . . . . 0.0 109.256 -177.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -68.0 121.3 15.8 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.859 -178.531 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 29.1 ptt180 -84.41 92.42 8.05 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.057 0.943 . . . . 0.0 110.06 178.515 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 36.0 p -155.62 80.21 1.02 Allowed 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.352 0.596 . . . . 0.0 109.99 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 63.0 t30 -95.28 78.41 3.46 Favored 'General case' 0 C--O 1.244 0.766 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 178.372 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -89.53 79.6 6.86 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -68.75 102.78 1.6 Allowed 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 113.63 -1.623 . . . . 0.0 111.287 -176.263 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 47.7 t -124.14 -43.75 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 176.306 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 30.0 tp -83.55 125.5 31.84 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.181 175.519 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -93.5 12.82 23.77 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 123.545 0.738 . . . . 0.0 111.144 -175.361 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -83.32 13.68 4.14 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.323 0.649 . . . . 0.0 111.351 174.55 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.426 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 68.5 mt -79.62 -70.28 0.52 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 122.94 0.496 . . . . 0.0 110.413 178.01 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 127.0 114.51 1.88 Allowed Glycine 0 N--CA 1.472 1.035 0 N-CA-C 110.819 -0.913 . . . . 0.0 110.819 -176.392 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -49.93 -52.62 31.93 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.273 1.429 . . . . 0.0 113.37 -170.425 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 7.4 p -53.08 -42.56 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 123.234 0.614 . . . . 0.0 112.205 -178.623 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -74.74 -32.83 56.73 Favored Glycine 0 C--N 1.344 1.011 0 CA-C-N 115.538 -0.756 . . . . 0.0 112.113 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -68.34 -45.76 71.99 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.626 0.77 . . . . 0.0 111.43 -179.034 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -64.76 -36.75 85.32 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.542 0.737 . . . . 0.0 109.662 176.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.31 -48.56 75.18 Favored 'General case' 0 C--N 1.354 0.789 0 O-C-N 124.122 0.889 . . . . 0.0 110.467 177.416 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.4 mp -57.38 -46.62 83.2 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.175 0.99 . . . . 0.0 110.635 177.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 77.2 ttt180 -62.24 -37.1 84.11 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.508 -178.1 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.454 ' HB1' ' O ' ' A' ' 101' ' ' TYR . . . -74.53 -39.33 62.43 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 123.995 0.918 . . . . 0.0 111.542 179.201 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.592 HG21 ' HB3' ' A' ' 20' ' ' GLN . 85.3 mt -73.06 -54.92 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 123.785 0.834 . . . . 0.0 110.39 -176.706 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -59.67 -30.18 68.58 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.05 0.94 . . . . 0.0 111.789 176.655 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.476 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -64.11 -52.68 57.99 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 123.429 0.456 . . . . 0.0 110.319 172.094 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.466 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -61.2 -40.41 93.84 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.929 0.892 . . . . 0.0 111.496 -178.138 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.519 HD23 HD12 ' A' ' 76' ' ' ILE . 66.1 mt -67.84 -37.1 81.46 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.711 1.205 . . . . 0.0 111.505 178.842 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.61 -33.04 75.01 Favored 'General case' 0 N--CA 1.478 0.951 0 O-C-N 123.615 0.572 . . . . 0.0 110.296 173.723 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.476 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 79.7 mtt-85 -79.99 -25.91 40.12 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.274 0.629 . . . . 0.0 111.466 178.288 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.519 HD12 HD23 ' A' ' 73' ' ' LEU . 98.1 mt -71.33 -49.9 44.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 175.708 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.19 -28.09 68.49 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.606 0.762 . . . . 0.0 111.106 178.429 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 30.5 t -75.56 -34.22 60.7 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.43 0.692 . . . . 0.0 110.627 172.397 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 90.78 7.94 65.88 Favored Glycine 0 CA--C 1.53 0.989 0 CA-C-N 115.759 -0.655 . . . . 0.0 113.158 -176.011 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 14.0 t -97.44 10.35 39.95 Favored 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 123.669 0.788 . . . . 0.0 110.481 178.019 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -64.93 136.55 56.95 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.082 0.553 . . . . 0.0 109.914 171.228 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.15 13.14 64.51 Favored Glycine 0 CA--C 1.527 0.803 0 O-C-N 123.619 0.575 . . . . 0.0 111.89 -169.349 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 89.4 m -125.68 119.67 28.63 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 123.741 0.816 . . . . 0.0 109.753 175.115 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.469 ' HB2' HD13 ' A' ' 91' ' ' ILE . 49.6 t -77.06 91.89 3.7 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 124.072 0.949 . . . . 0.0 109.743 170.635 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 25.3 m -64.35 -20.02 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 124.016 0.927 . . . . 0.0 112.152 -178.11 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 49.8 tttm -66.41 -22.8 66.24 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.928 0.891 . . . . 0.0 111.874 -179.239 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.428 ' SG ' ' HB2' ' A' ' 89' ' ' LYS . 31.7 p -137.85 10.07 2.85 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 122.635 0.374 . . . . 0.0 111.488 177.014 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 63.85 20.21 64.07 Favored Glycine 0 C--N 1.358 1.76 0 N-CA-C 114.185 0.434 . . . . 0.0 114.185 179.822 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.428 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 31.6 mmmt -106.92 -173.77 2.37 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.094 0.958 . . . . 0.0 110.62 -176.487 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 13.1 mmm180 -83.54 163.84 20.18 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 124.454 1.102 . . . . 0.0 112.139 176.683 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.469 HD13 ' HB2' ' A' ' 84' ' ' CYS . 5.7 mm -101.21 143.43 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 N-CA-C 106.416 -1.698 . . . . 0.0 106.416 159.361 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.6 m -70.9 140.82 51.13 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 173.64 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -61.06 -35.86 78.08 Favored 'General case' 0 N--CA 1.483 1.185 0 CA-C-N 117.95 0.341 . . . . 0.0 110.124 174.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -58.29 -40.92 83.23 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.187 0.995 . . . . 0.0 110.34 175.337 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.531 ' HD2' ' HB2' ' A' ' 106' ' ' GLN . 0.2 OUTLIER -68.71 -40.19 80.08 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.699 176.947 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 94.6 mt -69.01 -34.81 75.87 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.844 0.858 . . . . 0.0 112.307 -176.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 15.5 ptpt -80.73 -27.08 36.99 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 122.627 0.371 . . . . 0.0 110.215 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -79.31 -29.36 42.34 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.643 0.777 . . . . 0.0 110.999 175.309 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.422 ' O ' HG22 ' A' ' 102' ' ' THR . 2.3 p -165.84 99.9 0.74 Allowed Pre-proline 0 CA--C 1.557 1.244 0 C-N-CA 124.828 1.251 . . . . 0.0 108.909 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' PRO . . . . . 0.423 ' HG2' HD21 ' A' ' 16' ' ' LEU . 79.2 Cg_endo -78.21 -12.93 15.65 Favored 'Trans proline' 0 C--N 1.373 1.845 0 C-N-CA 122.65 2.233 . . . . 0.0 113.681 179.113 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' TYR . . . . . 0.454 ' O ' ' HB1' ' A' ' 68' ' ' ALA . 24.0 p90 -94.66 22.02 6.73 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 122.601 0.361 . . . . 0.0 111.932 -179.211 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.422 HG22 ' O ' ' A' ' 99' ' ' VAL . 14.1 t -97.51 112.48 61.35 Favored Pre-proline 0 CA--C 1.56 1.358 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 172.526 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -78.39 -4.44 14.22 Favored 'Trans proline' 0 C--N 1.376 1.977 0 C-N-CA 122.635 2.224 . . . . 0.0 112.009 171.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -114.75 146.15 41.29 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.957 0.903 . . . . 0.0 109.975 -176.609 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 26.0 p -75.67 160.72 29.77 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 175.239 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.531 ' HB2' ' HD2' ' A' ' 95' ' ' ARG . 52.0 tp60 -56.61 -29.95 62.73 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 118.387 0.539 . . . . 0.0 111.779 -175.312 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -61.57 -49.75 75.41 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 124.826 1.25 . . . . 0.0 109.844 177.061 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 98.3 m -70.3 -36.29 74.25 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.346 0.658 . . . . 0.0 111.662 177.047 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -61.38 -33.97 74.55 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.782 0.833 . . . . 0.0 110.968 179.227 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -82.6 -28.91 30.52 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.819 0.847 . . . . 0.0 111.152 175.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -105.47 24.46 12.12 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 124.065 0.946 . . . . 0.0 112.61 -174.418 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 86.3 mt . . . . . 0 N--CA 1.487 1.412 0 C-N-CA 123.464 0.706 . . . . 0.0 111.193 177.976 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 7.8 mp . . . . . 0 N--CA 1.476 0.853 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -162.05 16.15 0.09 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.541 1.136 . . . . 0.0 109.808 174.614 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -69.79 138.21 29.69 Favored Glycine 0 C--N 1.356 1.661 0 CA-C-N 115.952 -0.567 . . . . 0.0 113.32 -174.672 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 86.37 140.66 5.97 Favored Glycine 0 C--N 1.348 1.235 0 N-CA-C 111.977 -0.449 . . . . 0.0 111.977 -177.104 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -102.29 17.28 23.84 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.966 0.906 . . . . 0.0 111.143 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 32.8 m -61.91 -44.52 96.62 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.78 0.832 . . . . 0.0 111.842 -175.043 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 45.5 ttm -71.81 -38.06 70.27 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.047 177.387 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 52.5 t30 57.27 100.1 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 125.6 1.56 . . . . 0.0 112.026 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.8 t -71.57 -26.43 26.24 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.034 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.199 -179.118 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -58.53 -42.21 87.26 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 123.207 0.603 . . . . 0.0 112.544 -174.241 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 33.2 m -59.73 -41.86 91.83 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 121.352 0.596 . . . . 0.0 110.833 178.034 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -71.34 -38.39 71.66 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-N 114.942 -1.026 . . . . 0.0 110.487 179.024 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.469 ' O ' ' HG3' ' A' ' 17' ' ' ARG . 3.0 tm-20 -57.9 -54.95 41.09 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.507 1.123 . . . . 0.0 110.127 -177.546 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.56 -41.59 88.4 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.171 -176.771 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 14.9 tt -68.22 -29.94 46.14 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 N-CA-C 110.329 -0.249 . . . . 0.0 110.329 -177.475 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.541 ' HB3' HG23 ' A' ' 69' ' ' ILE . 77.5 mt -73.35 -33.19 64.96 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.673 0.789 . . . . 0.0 111.168 176.977 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.469 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 25.7 mtm180 -64.51 -37.51 87.78 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 175.274 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -82.52 -24.68 33.98 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.002 0.521 . . . . 0.0 110.522 -178.536 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.428 ' HD2' ' HA ' ' A' ' 19' ' ' ARG . 18.4 tpt180 -73.45 -43.45 60.29 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.505 179.347 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.576 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.7 pt20 -73.45 -29.46 62.56 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 119.005 -0.521 . . . . 0.0 110.018 176.467 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 91.8 mtt180 -55.29 -58.29 8.32 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 172.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.4 ' HA ' ' HE ' ' A' ' 25' ' ' ARG . 11.7 pt-20 -63.78 -38.24 90.37 Favored 'General case' 0 C--N 1.352 0.686 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.098 -175.166 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.712 HD23 HH11 ' A' ' 26' ' ' ARG . 89.4 mt -65.34 -52.24 55.12 Favored 'General case' 0 C--O 1.216 -0.688 0 O-C-N 123.877 0.735 . . . . 0.0 110.956 177.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -48.0 -53.49 16.03 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 124.303 1.041 . . . . 0.0 111.25 -178.575 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.4 ' HE ' ' HA ' ' A' ' 22' ' ' GLU . 29.8 ptt180 -74.88 -26.19 59.49 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -178.713 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.712 HH11 HD23 ' A' ' 23' ' ' LEU . 39.5 ttm180 -66.58 -48.94 67.97 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.832 0.853 . . . . 0.0 111.124 175.607 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.553 HD21 HD22 ' A' ' 66' ' ' LEU . 4.1 pp -80.38 -24.69 39.59 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.31 0.644 . . . . 0.0 110.679 -178.192 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 3.3 m-70 -80.92 21.04 0.72 Allowed 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.171 0.589 . . . . 0.0 111.21 171.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.1 pttp -49.12 -29.28 5.09 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 124.811 1.245 . . . . 0.0 113.124 175.461 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.47 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -68.27 -30.26 47.16 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.161 0 C-N-CA 123.88 0.872 . . . . 0.0 112.316 179.491 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -121.95 -5.85 9.02 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 124.176 0.99 . . . . 0.0 111.462 -173.141 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -109.38 105.42 14.79 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.007 0.923 . . . . 0.0 108.695 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -83.19 78.1 9.66 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 123.54 0.736 . . . . 0.0 109.101 -176.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 61.1 t80 56.17 80.78 0.14 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.55 1.14 . . . . 0.0 111.185 -173.514 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -88.82 -18.52 27.49 Favored 'General case' 0 CA--C 1.551 1.002 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 173.506 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 68.97 118.86 0.03 OUTLIER Pre-proline 0 C--N 1.362 1.123 0 C-N-CA 126.001 1.72 . . . . 0.0 110.757 -177.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -50.56 -40.04 55.14 Favored 'Trans proline' 0 C--N 1.386 2.552 0 C-N-CA 123.68 2.92 . . . . 0.0 113.388 -176.803 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 25.4 ptt180 -141.87 92.5 2.45 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-O 122.105 0.955 . . . . 0.0 110.693 -177.071 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 21.0 p-10 -75.2 124.53 89.32 Favored Pre-proline 0 CA--C 1.542 0.658 0 CA-C-N 114.903 -1.044 . . . . 0.0 108.638 169.185 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -65.7 -27.71 52.42 Favored 'Trans proline' 0 C--N 1.371 1.735 0 C-N-CA 122.58 2.186 . . . . 0.0 112.305 -177.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -106.75 97.38 7.17 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 108.177 -1.045 . . . . 0.0 108.177 176.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -74.83 110.68 9.32 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 121.342 0.592 . . . . 0.0 110.611 -179.241 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -81.08 -39.32 25.89 Favored 'General case' 0 C--O 1.242 0.66 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 168.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.8 t70 73.27 143.39 0.07 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.833 1.653 . . . . 0.0 113.251 171.657 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 30.3 mmt180 -128.42 98.48 5.06 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 113.91 -1.496 . . . . 0.0 107.543 168.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -79.56 54.3 1.74 Allowed 'General case' 0 CA--C 1.549 0.933 0 CA-C-O 122.057 0.932 . . . . 0.0 108.963 168.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 35.3 t -91.52 175.24 6.98 Favored 'General case' 0 C--O 1.241 0.617 0 C-N-CA 124.73 1.212 . . . . 0.0 109.883 -172.563 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -74.93 161.21 29.71 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-O 121.479 0.657 . . . . 0.0 111.471 176.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 74.6 mtm180 -83.28 -63.79 1.29 Allowed 'General case' 0 C--O 1.239 0.531 0 CA-C-N 114.457 -1.247 . . . . 0.0 109.418 -174.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 25.0 t 62.91 164.42 0.11 Allowed 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 124.727 1.211 . . . . 0.0 112.288 176.341 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 63.0 t30 64.96 100.03 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.062 0.945 . . . . 0.0 111.185 178.309 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -81.89 -2.61 51.82 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.059 0.544 . . . . 0.0 112.26 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 44.9 mm-40 -62.9 133.69 55.07 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.347 0.659 . . . . 0.0 111.143 178.049 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 43.8 t -69.19 -48.38 69.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 176.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 34.4 tp 59.57 107.2 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.896 0 O-C-N 125.168 1.543 . . . . 0.0 112.129 174.724 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -69.86 -10.14 57.38 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.492 0.717 . . . . 0.0 111.843 -178.758 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -81.63 -6.49 59.05 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.378 0.671 . . . . 0.0 111.593 176.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.478 HD13 HD13 ' A' ' 27' ' ' LEU . 31.8 mt -83.43 136.86 34.15 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 167.714 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -58.68 130.12 50.58 Favored Glycine 0 CA--C 1.534 1.242 0 CA-C-O 119.207 -0.774 . . . . 0.0 112.197 176.881 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -67.15 -42.21 84.75 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.304 0.642 . . . . 0.0 112.313 -171.596 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 7.3 p -59.9 -32.09 49.07 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 C-N-CA 122.926 0.491 . . . . 0.0 109.74 173.35 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.529 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -64.86 -56.69 15.01 Favored Glycine 0 C--O 1.214 -1.104 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.615 174.586 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 22.5 mt-30 -58.9 -43.77 91.07 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 125.173 1.389 . . . . 0.0 111.946 -176.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -67.28 -49.11 65.57 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.125 -175.633 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -70.02 -28.9 65.87 Favored 'General case' 0 C--O 1.217 -0.614 0 CA-C-N 114.649 -1.16 . . . . 0.0 110.24 179.34 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.553 HD22 HD21 ' A' ' 27' ' ' LEU . 11.1 tp -64.24 -44.79 90.74 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.358 1.063 . . . . 0.0 109.551 178.874 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 65.2 ttt180 -74.95 -29.48 60.94 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 114.736 -1.12 . . . . 0.0 110.507 -179.307 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.57 -41.34 88.72 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.423 0.689 . . . . 0.0 110.247 174.723 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.576 HG21 ' HB3' ' A' ' 20' ' ' GLN . 95.5 mt -70.56 -37.76 71.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.887 0.875 . . . . 0.0 109.875 175.885 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -63.24 -36.43 83.62 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.272 0.629 . . . . 0.0 110.268 176.534 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -75.88 -34.08 59.98 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.906 0.882 . . . . 0.0 111.113 177.461 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.473 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -69.92 -53.88 15.88 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.441 0.696 . . . . 0.0 110.73 -179.408 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.583 HD23 HD12 ' A' ' 76' ' ' ILE . 95.5 mt -61.78 -31.94 72.19 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.455 1.102 . . . . 0.0 111.249 176.751 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.53 -49.69 76.54 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 123.615 0.572 . . . . 0.0 110.175 172.634 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.464 ' HE ' ' HA ' ' A' ' 72' ' ' ALA . 86.8 mtm180 -63.56 -30.9 71.95 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 124.043 0.839 . . . . 0.0 111.844 178.427 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.583 HD12 HD23 ' A' ' 73' ' ' LEU . 66.4 mt -69.24 -43.42 81.37 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 177.019 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.62 -25.23 64.74 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.941 176.088 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 69.8 m -91.61 -7.55 49.78 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.413 1.085 . . . . 0.0 112.344 178.481 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 69.33 23.46 76.36 Favored Glycine 0 C--N 1.35 1.325 0 N-CA-C 113.77 0.268 . . . . 0.0 113.77 178.258 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 9.9 t -129.85 29.34 5.0 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 124.589 1.156 . . . . 0.0 110.449 -179.639 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -63.97 148.66 49.07 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 121.938 -0.476 . . . . 0.0 110.271 171.573 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.462 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 70.09 37.72 73.07 Favored Glycine 0 C--N 1.342 0.866 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.611 -175.267 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 90.8 m -129.45 124.06 33.13 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.588 0.755 . . . . 0.0 109.448 175.642 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.421 ' HB3' ' HB2' ' A' ' 87' ' ' CYS . 37.5 t -67.85 108.37 2.97 Favored 'General case' 0 C--N 1.35 0.622 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 169.94 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 29.2 m -62.34 -28.47 44.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 O-C-N 124.134 0.896 . . . . 0.0 111.167 176.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 38.3 tttm -81.11 -8.04 59.68 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.518 1.127 . . . . 0.0 111.673 -177.758 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.529 ' HB3' ' HG2' ' A' ' 89' ' ' LYS . 60.8 m -122.07 -24.1 5.22 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.895 0.878 . . . . 0.0 111.696 176.678 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 62.77 46.58 93.35 Favored Glycine 0 CA--C 1.537 1.425 0 O-C-N 123.508 0.505 . . . . 0.0 113.178 -168.646 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.529 ' HG2' ' HB3' ' A' ' 87' ' ' CYS . 0.0 OUTLIER -159.88 171.17 19.91 Favored 'General case' 0 N--CA 1.498 1.945 0 N-CA-C 112.616 0.598 . . . . 0.0 112.616 -179.103 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.462 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 13.9 tpp180 -64.4 144.11 57.41 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 125.377 1.471 . . . . 0.0 113.192 -172.462 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 26.1 mm -91.73 149.7 4.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 125.179 1.392 . . . . 0.0 108.847 172.069 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 24.8 m -67.58 140.59 56.94 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 174.452 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -59.21 -36.54 75.59 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 122.869 0.468 . . . . 0.0 111.209 -178.684 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -63.96 -36.05 82.68 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.658 0.783 . . . . 0.0 111.267 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.523 ' HD2' ' HB2' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -65.57 -40.71 93.09 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.221 175.45 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 95.2 mt -75.07 -31.74 61.31 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -176.378 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.2 ptpt -76.03 -28.17 57.61 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 109.827 -0.435 . . . . 0.0 109.827 178.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -83.48 -35.24 25.05 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.671 0.788 . . . . 0.0 111.316 176.502 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.4 p -158.53 91.9 2.06 Favored Pre-proline 0 CA--C 1.557 1.237 0 C-N-CA 124.536 1.134 . . . . 0.0 109.055 -177.162 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' PRO . . . . . 0.527 ' HG2' HD21 ' A' ' 16' ' ' LEU . 58.8 Cg_endo -74.06 -28.27 11.12 Favored 'Trans proline' 0 C--N 1.377 2.069 0 C-N-CA 122.639 2.226 . . . . 0.0 113.324 -178.805 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' TYR . . . . . 0.458 ' HA ' ' HB2' ' A' ' 72' ' ' ALA . 29.6 p90 -77.96 -2.55 37.51 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -173.407 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.1 t -65.62 116.77 34.82 Favored Pre-proline 0 CA--C 1.563 1.457 0 CA-C-N 117.862 0.301 . . . . 0.0 110.72 -179.268 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -73.45 -16.51 24.38 Favored 'Trans proline' 0 C--N 1.381 2.259 0 C-N-CA 122.489 2.126 . . . . 0.0 111.474 175.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.489 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 12.7 m-85 -113.11 174.83 5.71 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.421 1.088 . . . . 0.0 110.279 -176.262 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 31.1 p -98.19 173.97 6.75 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.193 0.597 . . . . 0.0 109.812 175.76 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.523 ' HB2' ' HD2' ' A' ' 95' ' ' ARG . 6.6 tp60 -56.66 -38.94 72.89 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.443 0.697 . . . . 0.0 112.325 -177.042 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -64.24 -48.51 75.52 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.169 0.588 . . . . 0.0 111.404 179.186 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.489 ' HB2' ' HB3' ' A' ' 104' ' ' PHE . 97.0 m -64.85 -36.17 83.47 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.044 0.538 . . . . 0.0 110.91 176.442 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.58 -35.25 78.65 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.824 0.849 . . . . 0.0 110.68 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -77.09 -25.37 52.21 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.784 175.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -90.62 -5.4 55.91 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.743 0.817 . . . . 0.0 112.098 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 108' ' ' CYS . 70.8 mt . . . . . 0 N--CA 1.48 1.066 0 C-N-CA 122.943 0.497 . . . . 0.0 109.665 173.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.432 ' HB2' HG21 ' A' ' 83' ' ' THR . 2.4 pt? . . . . . 0 N--CA 1.484 1.23 0 CA-C-O 120.639 0.257 . . . . 0.0 111.202 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -69.2 147.45 51.27 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.842 0.857 . . . . 0.0 111.876 -179.583 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -154.12 -29.0 0.03 OUTLIER Glycine 0 C--N 1.339 0.721 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.939 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 81.53 -124.09 6.31 Favored Glycine 0 C--N 1.346 1.107 0 CA-C-N 115.506 -0.347 . . . . 0.0 112.775 175.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.543 ' HA ' ' HB ' ' A' ' 9' ' ' VAL . 33.3 mmtp -109.61 0.04 18.9 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.923 0.889 . . . . 0.0 111.783 179.447 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.0 m -69.23 151.26 46.51 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.366 0.666 . . . . 0.0 110.17 173.639 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 33.9 ttp 70.0 44.66 0.78 Allowed 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 122.231 1.015 . . . . 0.0 109.63 -173.246 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 58.87 31.92 21.74 Favored 'General case' 0 N--CA 1.485 1.322 0 CA-C-N 114.653 -1.158 . . . . 0.0 113.107 166.601 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.543 ' HB ' ' HA ' ' A' ' 5' ' ' LYS . 88.6 t -60.93 -28.6 43.81 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 CA-C-O 119.064 -0.493 . . . . 0.0 111.826 -176.222 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -59.5 -49.17 78.81 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 174.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.9 m -58.43 -42.45 87.31 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.891 0.876 . . . . 0.0 110.755 179.73 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -73.16 -32.45 64.87 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.112 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 9' ' ' VAL . 3.3 tm-20 -63.99 -54.19 38.26 Favored 'General case' 0 C--O 1.243 0.728 0 C-N-CA 124.535 1.134 . . . . 0.0 109.984 -177.019 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.6 -45.0 80.61 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 114.396 -1.275 . . . . 0.0 111.406 -177.254 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 10.8 tt -64.77 -33.4 63.14 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 CA-C-N 118.08 0.4 . . . . 0.0 110.713 -175.431 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.575 ' HB3' HG23 ' A' ' 69' ' ' ILE . 37.5 mt -65.77 -45.29 83.07 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.348 0.659 . . . . 0.0 111.127 175.497 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.508 ' O ' ' HG3' ' A' ' 21' ' ' ARG . 52.1 mtm180 -62.81 -46.47 87.81 Favored 'General case' 0 C--O 1.214 -0.783 0 O-C-N 123.647 0.592 . . . . 0.0 110.986 177.691 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -56.75 -46.97 81.08 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.686 0.795 . . . . 0.0 111.268 176.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? -66.24 -33.11 75.01 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.269 179.186 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.668 ' HB3' HG21 ' A' ' 69' ' ' ILE . 1.3 pt20 -81.78 -22.14 37.35 Favored 'General case' 0 C--O 1.21 -0.985 0 CA-C-O 118.805 -0.617 . . . . 0.0 110.486 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.508 ' HG3' ' O ' ' A' ' 17' ' ' ARG . 82.4 mtt180 -65.08 -49.21 70.91 Favored 'General case' 0 N--CA 1.484 1.273 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 175.891 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -65.76 -37.54 86.62 Favored 'General case' 0 C--N 1.355 0.84 0 O-C-N 123.962 0.789 . . . . 0.0 110.676 179.328 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 71.9 mt -69.21 -41.03 77.62 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 122.803 0.441 . . . . 0.0 111.704 177.264 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -63.16 -53.47 52.81 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.369 0.668 . . . . 0.0 109.817 -177.555 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -66.45 -26.65 67.3 Favored 'General case' 0 N--CA 1.484 1.263 0 O-C-N 123.204 0.315 . . . . 0.0 111.689 178.221 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 17.4 ttm-85 -65.13 -47.97 75.25 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.536 0.734 . . . . 0.0 111.462 176.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.627 HD21 HD22 ' A' ' 66' ' ' LEU . 4.0 pp -82.19 -30.18 31.07 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-O 120.64 0.257 . . . . 0.0 110.557 -178.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 87.8 m-70 -89.02 20.91 3.36 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.576 0.75 . . . . 0.0 110.958 174.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.5 pttp -49.1 -34.32 13.68 Favored 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 113.891 1.071 . . . . 0.0 113.891 -176.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.605 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.1 OUTLIER -60.99 -42.05 91.49 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.237 0 C-N-CA 123.972 0.909 . . . . 0.0 112.402 177.6 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -102.77 -15.3 16.31 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.581 0.752 . . . . 0.0 111.807 -176.498 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -115.19 53.15 0.83 Allowed 'General case' 0 N--CA 1.481 1.076 0 CA-C-O 122.635 1.207 . . . . 0.0 108.243 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -80.89 83.57 6.59 Favored 'General case' 0 CA--C 1.55 0.956 0 CA-C-N 113.244 -1.798 . . . . 0.0 111.087 -171.464 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -150.34 72.34 1.1 Allowed 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.446 1.099 . . . . 0.0 109.197 173.069 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -93.02 -5.05 51.43 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.438 0.695 . . . . 0.0 111.302 179.329 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -67.97 126.3 92.47 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 123.763 0.825 . . . . 0.0 109.965 -173.689 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -57.28 95.29 0.06 OUTLIER 'Trans proline' 0 C--N 1.385 2.495 0 C-N-CA 123.503 2.802 . . . . 0.0 112.444 -179.661 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 31.5 mmt180 58.88 91.89 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.095 1.358 . . . . 0.0 112.42 -177.281 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 -74.23 126.27 89.23 Favored Pre-proline 0 CA--C 1.554 1.119 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 166.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -68.84 -2.29 9.23 Favored 'Trans proline' 0 C--N 1.377 2.036 0 C-N-CA 122.983 2.455 . . . . 0.0 113.07 -175.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -135.59 96.45 3.45 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 170.476 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -111.93 -130.85 0.31 Allowed 'General case' 0 CA--C 1.551 0.991 0 CA-C-O 118.103 -0.951 . . . . 0.0 109.044 176.39 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 63.76 27.09 14.61 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 124.33 1.052 . . . . 0.0 109.94 -178.369 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -133.76 106.65 7.45 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.788 -174.646 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 4.8 mpt_? -119.42 40.69 3.29 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 170.275 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.51 74.45 0.77 Allowed 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.216 1.006 . . . . 0.0 111.27 -174.409 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.9 t -174.6 171.02 3.36 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.567 1.147 . . . . 0.0 109.184 -171.549 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 71.33 14.17 6.51 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 124.429 1.092 . . . . 0.0 111.428 177.141 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -72.08 -21.64 61.47 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.555 0.742 . . . . 0.0 111.061 178.38 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.3 m -91.01 -76.95 0.43 Allowed 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 172.59 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.3 t30 59.07 12.16 2.31 Favored 'General case' 0 CA--C 1.568 1.663 0 C-N-CA 124.909 1.284 . . . . 0.0 111.803 178.03 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -81.27 -33.28 32.8 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.743 0.817 . . . . 0.0 111.021 -171.492 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -74.91 146.4 41.85 Favored 'General case' 0 C--O 1.243 0.733 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.79 177.718 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 42.3 t -72.34 -52.6 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.777 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 30.2 tp 68.56 129.41 0.03 OUTLIER 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 125.348 1.459 . . . . 0.0 112.755 175.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -86.16 -11.59 52.14 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 124.049 0.94 . . . . 0.0 112.3 -178.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -81.62 3.85 23.72 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.437 0.695 . . . . 0.0 111.904 -178.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.437 HD13 HD13 ' A' ' 27' ' ' LEU . 11.1 mt -86.74 155.21 20.43 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 174.816 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -86.83 135.77 13.5 Favored Glycine 0 N--CA 1.467 0.723 0 CA-C-O 119.153 -0.804 . . . . 0.0 111.1 173.184 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -56.89 -51.7 68.05 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.441 1.097 . . . . 0.0 111.811 -176.661 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.5 t -65.34 -33.87 66.62 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 124.133 0.973 . . . . 0.0 110.117 178.212 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.614 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -64.43 -39.96 97.35 Favored Glycine 0 C--O 1.217 -0.927 0 O-C-N 123.487 0.492 . . . . 0.0 111.94 177.474 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -75.66 -38.37 58.84 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.373 1.069 . . . . 0.0 111.484 -178.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -80.75 -36.58 31.77 Favored 'General case' 0 N--CA 1.485 1.316 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.094 -173.622 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -69.85 -36.08 75.24 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 173.63 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.627 HD22 HD21 ' A' ' 27' ' ' LEU . 9.5 tp -57.86 -47.57 82.35 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.168 0.987 . . . . 0.0 109.839 171.796 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 38.8 ttt180 -56.92 -44.17 82.17 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.864 1.265 . . . . 0.0 111.193 177.827 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.8 -38.19 88.3 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.579 0.752 . . . . 0.0 110.749 179.473 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.668 HG21 ' HB3' ' A' ' 20' ' ' GLN . 74.6 mt -65.78 -50.65 69.37 Favored 'Isoleucine or valine' 0 C--N 1.351 0.647 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.332 177.217 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -68.92 -28.75 66.95 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.176 0.991 . . . . 0.0 111.617 -176.479 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.32 -44.91 77.99 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.469 0.707 . . . . 0.0 109.621 175.479 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.5 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -64.48 -45.78 85.86 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 114.76 -1.109 . . . . 0.0 110.633 177.257 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.624 HD23 HD12 ' A' ' 76' ' ' ILE . 92.6 mt -64.16 -34.28 77.7 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 124.479 1.112 . . . . 0.0 111.636 179.041 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.59 -42.17 98.47 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 123.985 0.803 . . . . 0.0 109.947 176.331 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 58.3 mtp85 -74.72 -25.43 59.12 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 114.804 -1.089 . . . . 0.0 111.881 178.721 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.624 HD12 HD23 ' A' ' 73' ' ' LEU . 47.6 mt -67.82 -44.93 85.15 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 CA-C-N 118.662 0.664 . . . . 0.0 109.957 175.077 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.34 -39.21 89.74 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 124.085 0.866 . . . . 0.0 110.379 174.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 27.5 t -78.3 -10.72 59.79 Favored 'General case' 0 CA--C 1.555 1.164 0 CA-C-N 115.074 -0.966 . . . . 0.0 111.725 179.355 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 77.0 10.22 86.37 Favored Glycine 0 C--N 1.351 1.411 0 N-CA-C 113.765 0.266 . . . . 0.0 113.765 178.357 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 7.5 t -117.87 27.98 8.69 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 124.724 1.21 . . . . 0.0 111.08 -179.354 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.457 ' HE1' ' HB1' ' A' ' 72' ' ' ALA . 80.1 t80 -53.43 149.14 8.01 Favored 'General case' 0 N--CA 1.485 1.313 0 O-C-N 121.901 -0.499 . . . . 0.0 111.867 170.58 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.54 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 69.52 41.83 75.05 Favored Glycine 0 C--O 1.212 -1.253 0 CA-C-N 114.619 -1.173 . . . . 0.0 111.149 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' THR . . . . . 0.432 HG21 ' HB2' ' A' ' 1' ' ' LEU . 31.5 m -124.82 108.75 12.26 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-O 121.265 0.555 . . . . 0.0 109.629 176.89 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 51.4 t -62.52 98.6 0.12 Allowed 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 114.366 -1.288 . . . . 0.0 110.659 172.085 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 27.5 m -63.65 -23.71 34.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 O-C-N 124.381 1.05 . . . . 0.0 112.374 -175.019 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.494 ' HD3' ' HB3' ' A' ' 108' ' ' CYS . 47.0 tttm -67.76 -26.32 66.06 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.453 0.701 . . . . 0.0 112.046 -177.281 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 31.9 p -133.52 4.25 3.64 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 122.614 0.366 . . . . 0.0 111.648 179.82 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 61.08 28.42 68.9 Favored Glycine 0 C--N 1.351 1.395 0 N-CA-C 114.483 0.553 . . . . 0.0 114.483 -179.616 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 46.9 mtmt -116.38 166.27 12.26 Favored 'General case' 0 N--CA 1.487 1.404 0 CA-C-N 117.238 0.519 . . . . 0.0 110.67 -177.086 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.54 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 7.2 tpp180 -67.21 146.63 54.0 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 124.517 1.127 . . . . 0.0 111.116 177.078 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 10.5 mm -85.77 144.27 9.87 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 170.155 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 5.4 m -67.94 142.19 56.09 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 109.049 -0.722 . . . . 0.0 109.049 176.431 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -62.29 -29.14 70.22 Favored 'General case' 0 N--CA 1.484 1.272 0 CA-C-N 118.294 0.497 . . . . 0.0 109.976 174.242 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -57.0 -52.96 63.17 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.534 1.134 . . . . 0.0 111.248 169.457 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.57 -35.51 80.75 Favored 'General case' 0 C--O 1.214 -0.809 0 O-C-N 124.296 0.997 . . . . 0.0 110.011 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 89.4 mt -72.69 -40.39 66.26 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.467 0.707 . . . . 0.0 111.841 -179.288 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.411 ' HZ3' ' HB3' ' A' ' 97' ' ' LYS . 0.3 OUTLIER -75.01 -28.29 60.46 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.362 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.32 -43.5 50.5 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.973 0.909 . . . . 0.0 110.842 173.541 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.3 p -151.85 99.73 2.92 Favored Pre-proline 0 CA--C 1.554 1.098 0 C-N-CA 124.6 1.16 . . . . 0.0 108.876 -177.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -66.65 -24.87 47.5 Favored 'Trans proline' 0 C--N 1.373 1.86 0 C-N-CA 122.789 2.326 . . . . 0.0 113.434 179.502 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 28.4 p90 -93.36 54.63 2.11 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.134 0.974 . . . . 0.0 110.677 -178.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 4.1 t -112.76 103.52 55.61 Favored Pre-proline 0 CA--C 1.554 1.1 0 C-N-CA 123.434 0.694 . . . . 0.0 110.696 -179.066 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -76.26 -9.48 19.02 Favored 'Trans proline' 0 C--N 1.376 1.976 0 C-N-CA 122.852 2.368 . . . . 0.0 112.215 168.724 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -127.08 117.17 21.9 Favored 'General case' 0 C--N 1.359 1.005 0 C-N-CA 123.501 0.721 . . . . 0.0 110.31 -174.085 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 16.7 p -64.09 159.22 20.81 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 118.145 -0.931 . . . . 0.0 109.28 175.181 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -44.91 -39.38 5.39 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 124.313 1.045 . . . . 0.0 113.493 -169.404 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -58.09 -53.79 54.22 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.155 0.982 . . . . 0.0 111.217 176.565 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.494 ' HB3' ' HD3' ' A' ' 86' ' ' LYS . 85.0 m -73.4 -31.88 64.13 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 114.759 -1.109 . . . . 0.0 111.754 -176.376 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.9 -38.91 92.55 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.127 0.971 . . . . 0.0 110.507 176.482 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.75 -30.19 62.65 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.489 0.716 . . . . 0.0 110.876 174.338 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -79.42 -6.1 56.12 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.822 0.849 . . . . 0.0 112.453 -179.509 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 73.1 mt . . . . . 0 C--O 1.249 1.074 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 174.473 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.1 pt? . . . . . 0 N--CA 1.474 0.772 0 N-CA-C 109.684 -0.488 . . . . 0.0 109.684 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -90.96 142.37 27.84 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.288 0.635 . . . . 0.0 109.398 174.235 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 176.39 113.39 0.34 Allowed Glycine 0 C--N 1.34 0.766 0 N-CA-C 111.755 -0.538 . . . . 0.0 111.755 -178.494 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -84.69 99.82 2.33 Favored Glycine 0 C--N 1.345 1.076 0 N-CA-C 110.851 -0.9 . . . . 0.0 110.851 174.054 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.14 -45.7 90.27 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.032 0.933 . . . . 0.0 110.245 -178.778 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.8 m 66.39 -74.9 0.06 Allowed 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 125.366 1.466 . . . . 0.0 110.631 178.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 21.3 ptp -78.32 173.53 12.21 Favored 'General case' 0 C--O 1.242 0.69 0 C-N-CA 124.284 1.034 . . . . 0.0 110.534 175.603 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -77.66 79.33 4.16 Favored 'General case' 0 C--O 1.241 0.651 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 174.4 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 60.5 t -67.72 -33.94 64.8 Favored 'Isoleucine or valine' 0 C--N 1.347 0.482 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.225 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -65.34 -30.22 71.04 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 123.836 0.71 . . . . 0.0 111.697 179.003 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 47.5 m -65.88 -44.23 85.94 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 122.708 0.403 . . . . 0.0 110.061 173.632 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -67.95 -35.19 77.98 Favored 'General case' 0 C--O 1.217 -0.634 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.51 176.219 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.9 tm-20 -63.59 -55.31 24.77 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.299 1.039 . . . . 0.0 109.41 -176.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.422 ' HB2' ' HE3' ' A' ' 14' ' ' LYS . 15.4 ptmt -71.03 -35.46 71.99 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.252 -173.562 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.501 ' O ' ' HB2' ' A' ' 19' ' ' ARG . 12.3 tt -65.87 -33.95 67.02 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.551 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.55 ' HB3' HG23 ' A' ' 69' ' ' ILE . 69.6 mt -75.58 -34.05 60.64 Favored 'General case' 0 C--N 1.355 0.824 0 C-N-CA 123.952 0.901 . . . . 0.0 111.587 176.848 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.449 ' NH2' HD13 ' A' ' 73' ' ' LEU . 3.6 mmp_? -58.15 -49.91 75.35 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.097 0.559 . . . . 0.0 109.803 174.665 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -74.95 -27.93 60.38 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.02 0.528 . . . . 0.0 111.381 -179.01 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.501 ' HB2' ' O ' ' A' ' 15' ' ' ILE . 2.3 tpt180 -71.3 -41.98 69.26 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 123.622 0.577 . . . . 0.0 110.101 -178.217 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.621 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.5 pt20 -72.22 -30.35 64.83 Favored 'General case' 0 C--O 1.206 -1.22 0 CA-C-O 118.834 -0.603 . . . . 0.0 109.665 177.094 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.551 ' HB3' HH21 ' A' ' 25' ' ' ARG . 60.7 mtm-85 -68.43 -46.37 70.06 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.019 0.528 . . . . 0.0 111.999 179.66 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -63.58 -38.24 90.38 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 123.463 0.477 . . . . 0.0 110.428 177.385 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.565 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 81.5 mt -64.66 -48.77 73.57 Favored 'General case' 0 C--O 1.21 -0.981 0 O-C-N 123.495 0.497 . . . . 0.0 109.927 173.141 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.502 ' CE1' HD21 ' A' ' 66' ' ' LEU . 1.7 m-85 -57.41 -46.38 83.55 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.083 0.953 . . . . 0.0 110.871 -174.196 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.551 HH21 ' HB3' ' A' ' 21' ' ' ARG . 11.0 ptp180 -71.94 -28.11 63.24 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 122.747 0.419 . . . . 0.0 111.321 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 38.8 ttm180 -68.39 -56.52 8.21 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.435 0.694 . . . . 0.0 111.265 175.613 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 3.5 pp -80.88 -25.93 37.25 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.386 0.674 . . . . 0.0 111.51 -171.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.548 ' HB3' ' HG2' ' A' ' 31' ' ' GLU . 75.6 m-70 -86.63 34.55 0.65 Allowed 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 122.866 0.466 . . . . 0.0 110.109 169.676 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 20.8 pttp -50.7 -30.66 14.31 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 125.376 1.47 . . . . 0.0 112.398 170.526 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.5 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -69.78 -24.86 27.27 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.186 0 C-N-CA 123.834 0.854 . . . . 0.0 112.673 -178.15 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.548 ' HG2' ' HB3' ' A' ' 28' ' ' HIS . 10.5 pt-20 -105.58 -20.99 13.3 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.931 0.493 . . . . 0.0 110.377 173.393 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -78.41 112.58 15.59 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 179.907 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -75.57 -80.24 0.09 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.478 0.711 . . . . 0.0 110.904 -172.925 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -150.28 48.38 0.9 Allowed 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.662 0.785 . . . . 0.0 110.252 -177.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -83.47 -24.82 31.61 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.142 174.03 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 71.71 112.0 0.03 OUTLIER Pre-proline 0 CA--C 1.557 1.233 0 C-N-CA 125.493 1.517 . . . . 0.0 110.021 -172.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -62.52 105.02 0.39 Allowed 'Trans proline' 0 C--N 1.386 2.551 0 C-N-CA 123.141 2.561 . . . . 0.0 111.769 177.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 75.9 mtt180 -112.72 154.59 25.92 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.723 0.809 . . . . 0.0 110.765 -177.457 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -85.73 161.82 49.41 Favored Pre-proline 0 CA--C 1.556 1.198 0 C-N-CA 123.856 0.863 . . . . 0.0 109.392 175.229 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -65.71 87.85 0.22 Allowed 'Trans proline' 0 C--N 1.377 2.05 0 C-N-CA 122.668 2.245 . . . . 0.0 113.733 179.534 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -107.0 15.18 25.59 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.814 0.845 . . . . 0.0 108.957 163.595 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -85.01 162.48 19.34 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.255 1.422 . . . . 0.0 110.003 178.783 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -59.2 -73.93 0.08 Allowed 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.082 0.553 . . . . 0.0 110.293 173.145 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 28.0 t70 178.76 86.74 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.159 0.984 . . . . 0.0 109.837 -178.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 7.2 mpt_? -120.85 156.03 32.82 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.558 0.743 . . . . 0.0 109.67 171.455 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -94.98 15.68 18.14 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.943 0.897 . . . . 0.0 112.2 -177.698 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.6 m -62.93 97.66 0.11 Allowed 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 124.308 1.043 . . . . 0.0 112.012 -173.747 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -102.65 159.46 15.44 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.632 1.173 . . . . 0.0 112.181 -170.198 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 34.5 mmm-85 -128.91 44.32 2.99 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.475 1.11 . . . . 0.0 108.197 170.865 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.5 m -65.61 -74.4 0.11 Allowed 'General case' 0 C--N 1.352 0.676 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.652 -172.571 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 56.1 t30 58.87 110.76 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.49 1.116 . . . . 0.0 111.792 -179.491 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -75.79 79.31 2.72 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.023 0.929 . . . . 0.0 111.016 -176.528 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -159.21 154.47 25.42 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.417 1.487 . . . . 0.0 108.605 169.01 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 47.0 t -90.92 -86.81 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 CA-C-O 118.779 -0.629 . . . . 0.0 109.337 178.797 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.451 ' HG ' ' H ' ' A' ' 57' ' ' GLU . 54.6 tp 69.12 133.92 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 124.972 1.309 . . . . 0.0 110.116 -171.76 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -74.17 -3.33 29.14 Favored 'General case' 0 N--CA 1.492 1.625 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -175.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.451 ' H ' ' HG ' ' A' ' 55' ' ' LEU . 41.4 mt-10 -88.09 20.03 3.37 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 123.64 0.776 . . . . 0.0 111.867 -179.009 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.475 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 50.0 mt -85.95 -85.06 0.16 Allowed 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 110.516 -0.179 . . . . 0.0 110.516 174.718 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 151.07 139.75 3.05 Favored Glycine 0 C--N 1.346 1.1 0 CA-C-O 119.711 -0.494 . . . . 0.0 111.889 -178.532 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -57.2 -63.89 1.07 Allowed 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.774 1.23 . . . . 0.0 113.18 -170.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 60.4 t -59.82 -33.81 53.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 C-N-CA 124.39 1.076 . . . . 0.0 110.759 -177.294 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.536 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -63.68 -54.96 27.81 Favored Glycine 0 C--O 1.215 -1.082 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.766 177.232 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -67.87 -37.42 81.79 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 124.363 1.065 . . . . 0.0 112.092 -174.058 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -67.81 -46.07 72.96 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 123.901 0.75 . . . . 0.0 110.472 -179.023 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -70.17 -35.08 73.74 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.1 178.003 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.536 ' HB2' ' O ' ' A' ' 62' ' ' GLY . 11.9 tp -60.3 -46.3 90.36 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 124.943 1.297 . . . . 0.0 110.459 -179.306 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -66.64 -39.74 88.41 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 124.632 1.207 . . . . 0.0 110.674 178.862 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.415 ' HB1' ' O ' ' A' ' 101' ' ' TYR . . . -64.03 -39.99 95.32 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.673 0.789 . . . . 0.0 110.849 179.282 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.621 HG21 ' HB3' ' A' ' 20' ' ' GLN . 89.4 mt -66.87 -46.03 86.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-N 114.841 -1.072 . . . . 0.0 109.745 176.361 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -65.03 -33.12 75.28 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.063 0.945 . . . . 0.0 111.271 -177.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.58 -44.07 75.18 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.626 0.77 . . . . 0.0 110.275 178.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.426 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -63.45 -49.97 71.56 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.893 178.573 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.453 HD23 HD12 ' A' ' 76' ' ' ILE . 69.1 mt -61.23 -38.24 85.93 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.805 1.242 . . . . 0.0 112.246 179.038 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.55 -42.54 98.99 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.423 0.689 . . . . 0.0 110.485 177.338 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 86.8 mtt-85 -75.24 -21.85 58.29 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 114.761 -1.109 . . . . 0.0 112.369 -178.673 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.453 HD12 HD23 ' A' ' 73' ' ' LEU . 89.6 mt -67.24 -47.82 80.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 171.78 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -67.2 -30.64 70.64 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.362 178.024 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 29.1 t -80.48 -23.6 40.06 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.652 0.781 . . . . 0.0 111.113 177.529 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 87.99 7.29 74.29 Favored Glycine 0 C--N 1.35 1.333 0 C-N-CA 123.039 0.352 . . . . 0.0 113.657 -178.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.3 t -113.12 29.03 8.31 Favored 'General case' 0 CA--C 1.556 1.2 0 C-N-CA 124.082 0.953 . . . . 0.0 110.413 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -64.22 146.12 54.83 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 122.729 0.412 . . . . 0.0 110.413 169.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.503 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 74.36 31.32 59.28 Favored Glycine 0 C--N 1.341 0.842 0 O-C-N 123.82 0.7 . . . . 0.0 112.298 -177.748 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 26.6 m -117.89 110.85 18.25 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 122.887 0.475 . . . . 0.0 110.215 176.887 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.453 ' HB2' HD13 ' A' ' 91' ' ' ILE . 44.0 t -77.57 95.64 4.59 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.154 0.981 . . . . 0.0 110.101 174.728 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 30.9 m -62.56 -30.77 49.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 O-C-N 124.138 0.898 . . . . 0.0 113.077 -175.44 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.543 ' HE3' HD21 ' A' ' 112' ' ' LEU . 22.7 ttmm -60.56 -32.19 71.28 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.439 0.696 . . . . 0.0 112.535 -176.862 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.531 ' SG ' ' HB2' ' A' ' 89' ' ' LYS . 28.7 p -119.83 1.73 11.02 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 122.45 0.3 . . . . 0.0 111.273 175.342 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 62.76 20.82 62.38 Favored Glycine 0 C--N 1.351 1.39 0 CA-C-O 120.065 -0.297 . . . . 0.0 113.388 -177.069 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.531 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 11.0 mmpt? -106.46 177.06 4.97 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.48 0.712 . . . . 0.0 110.534 -176.689 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.503 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 21.8 tpp85 -78.83 144.97 34.53 Favored 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 124.197 0.999 . . . . 0.0 110.415 177.409 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.453 HD13 ' HB2' ' A' ' 84' ' ' CYS . 5.3 mm -79.94 144.89 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 168.297 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 19.7 m -74.55 149.31 40.23 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 110.403 -0.221 . . . . 0.0 110.403 178.748 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.443 ' HG2' ' HE3' ' A' ' 97' ' ' LYS . 30.6 tt0 -60.07 -42.96 95.68 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.854 0.862 . . . . 0.0 110.598 174.09 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -57.21 -43.7 83.03 Favored 'General case' 0 N--CA 1.482 1.151 0 O-C-N 124.497 1.123 . . . . 0.0 110.546 176.414 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.549 ' HG3' HG21 ' A' ' 102' ' ' THR . 26.5 tpt180 -64.43 -43.37 94.54 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 114.488 -1.233 . . . . 0.0 110.869 179.074 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 75.2 mt -71.46 -33.68 69.54 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.302 0.641 . . . . 0.0 112.624 -176.426 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.443 ' HE3' ' HG2' ' A' ' 93' ' ' GLU . 16.4 ptpt -79.75 -27.74 40.51 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 122.248 -0.283 . . . . 0.0 110.56 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -80.34 -33.66 37.22 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.859 0.864 . . . . 0.0 111.21 177.212 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.4 p -157.57 97.04 1.98 Allowed Pre-proline 0 CA--C 1.556 1.197 0 C-N-CA 124.78 1.232 . . . . 0.0 108.248 179.187 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -75.28 -8.81 20.06 Favored 'Trans proline' 0 C--N 1.377 2.067 0 C-N-CA 122.671 2.248 . . . . 0.0 113.724 -179.342 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' TYR . . . . . 0.415 ' O ' ' HB1' ' A' ' 68' ' ' ALA . 35.1 p90 -105.74 45.6 0.96 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.434 0.693 . . . . 0.0 110.991 -178.268 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.549 HG21 ' HG3' ' A' ' 95' ' ' ARG . 15.2 t -116.92 101.79 53.28 Favored Pre-proline 0 CA--C 1.564 1.508 0 CA-C-O 121.149 0.5 . . . . 0.0 110.216 -178.56 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.436 ' O ' ' HA ' ' A' ' 84' ' ' CYS . 32.4 Cg_exo -64.83 -24.54 61.22 Favored 'Trans proline' 0 C--N 1.378 2.109 0 C-N-CA 122.898 2.399 . . . . 0.0 113.317 174.835 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.401 ' HA ' ' SG ' ' A' ' 84' ' ' CYS . 6.6 m-85 -114.64 148.74 37.71 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.833 0.853 . . . . 0.0 109.297 -178.694 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.502 ' SG ' ' OE1' ' A' ' 107' ' ' GLU . 28.5 p -83.54 165.7 18.87 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 -178.482 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -46.78 -41.86 16.06 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 124.793 1.237 . . . . 0.0 114.204 -162.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.502 ' OE1' ' SG ' ' A' ' 105' ' ' CYS . 0.0 OUTLIER -82.95 -23.61 33.37 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-O 120.647 0.261 . . . . 0.0 111.556 -175.982 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.536 ' HB3' ' HD2' ' A' ' 86' ' ' LYS . 97.7 m -76.54 -29.83 56.87 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.23 1.012 . . . . 0.0 110.951 174.288 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -78.13 -34.57 49.84 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.505 0.722 . . . . 0.0 109.866 174.46 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.55 -21.72 61.12 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.874 0.87 . . . . 0.0 111.151 174.549 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -73.57 -26.79 60.99 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.778 0.831 . . . . 0.0 111.733 176.248 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.543 HD21 ' HE3' ' A' ' 86' ' ' LYS . 88.2 mt . . . . . 0 CA--C 1.553 1.085 0 C-N-CA 123.877 0.871 . . . . 0.0 110.623 -178.529 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 10.1 mp . . . . . 0 N--CA 1.478 0.943 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 77.82 -24.9 0.21 Allowed 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 125.835 1.654 . . . . 0.0 113.206 178.537 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 73.22 1.42 56.84 Favored Glycine 0 C--N 1.349 1.273 0 CA-C-O 119.658 -0.523 . . . . 0.0 113.76 -178.337 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 80.39 -57.12 4.69 Favored Glycine 0 C--N 1.355 1.589 0 C-N-CA 123.287 0.47 . . . . 0.0 112.733 -173.831 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.05 -169.46 3.26 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.018 0.927 . . . . 0.0 109.64 -175.035 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.1 t 71.11 -172.52 0.16 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.332 1.053 . . . . 0.0 111.768 169.61 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' MET . . . . . 0.436 ' HG2' ' HE2' ' A' ' 12' ' ' TYR . 60.2 ttp -58.31 -62.25 1.98 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.33 1.052 . . . . 0.0 110.685 178.561 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 62.6 t30 57.68 103.49 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 125.689 1.596 . . . . 0.0 112.547 178.41 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 99.4 t -59.4 -34.0 53.0 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.079 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.145 177.135 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -58.4 -43.81 88.76 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 124.465 1.106 . . . . 0.0 112.249 -179.294 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.9 m -57.68 -40.38 79.29 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.031 0.532 . . . . 0.0 110.262 177.588 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.516 ' HA ' HG22 ' A' ' 15' ' ' ILE . 25.2 m-85 -75.62 -34.81 60.59 Favored 'General case' 0 C--O 1.214 -0.799 0 CA-C-N 115.1 -0.955 . . . . 0.0 110.816 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -57.53 -53.23 60.45 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.407 1.083 . . . . 0.0 110.089 -177.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.423 ' NZ ' ' HB2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -71.72 -42.75 66.93 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.711 -176.701 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.516 HG22 ' HA ' ' A' ' 12' ' ' TYR . 11.6 tt -62.92 -34.25 65.11 Favored 'Isoleucine or valine' 0 C--N 1.37 1.489 0 CA-C-N 118.588 0.631 . . . . 0.0 110.083 -177.13 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.578 ' HB3' HG23 ' A' ' 69' ' ' ILE . 56.9 mt -65.13 -43.2 92.69 Favored 'General case' 0 C--N 1.345 0.406 0 C-N-CA 123.224 0.609 . . . . 0.0 110.898 175.827 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.423 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 97.4 mtt180 -63.87 -47.46 80.57 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 123.717 0.636 . . . . 0.0 111.88 177.884 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -63.71 -42.57 97.93 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 122.976 0.51 . . . . 0.0 111.204 -178.798 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -39.97 81.05 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.786 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.671 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.2 pt20 -70.16 -35.37 73.96 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 119.301 -0.381 . . . . 0.0 110.535 -178.706 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 71.1 mtp180 -69.47 -41.5 76.12 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.588 0.755 . . . . 0.0 111.363 -175.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -66.68 -34.41 77.81 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 175.164 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.602 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 86.1 mt -69.42 -38.53 77.94 Favored 'General case' 0 C--O 1.216 -0.671 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.924 174.763 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -60.85 -46.31 91.09 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 122.992 0.517 . . . . 0.0 110.304 -177.353 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 -69.95 -31.52 69.3 Favored 'General case' 0 N--CA 1.483 1.197 0 O-C-N 123.492 0.495 . . . . 0.0 110.634 178.814 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.42 ' O ' ' HE3' ' A' ' 29' ' ' LYS . 21.7 ttt85 -62.38 -59.48 4.94 Favored 'General case' 0 C--N 1.361 1.091 0 C-N-CA 123.533 0.733 . . . . 0.0 111.439 177.191 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.602 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 1.1 pp -80.19 -24.48 40.28 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 112.505 0.558 . . . . 0.0 112.505 -173.36 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -91.26 28.04 1.76 Allowed 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 123.04 0.536 . . . . 0.0 109.693 174.436 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.42 ' HE3' ' O ' ' A' ' 26' ' ' ARG . 7.6 ptpp? -49.53 -30.55 8.62 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 125.265 1.426 . . . . 0.0 113.484 -178.535 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.459 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -62.85 -36.3 74.93 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 123.864 0.866 . . . . 0.0 112.206 -177.9 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -106.07 -25.82 11.89 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.915 0.886 . . . . 0.0 110.733 -178.575 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -91.95 107.48 19.24 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.873 0.869 . . . . 0.0 110.009 -174.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -69.61 -22.55 63.49 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 123.451 0.7 . . . . 0.0 110.499 174.767 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -76.32 95.28 3.74 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.661 0.784 . . . . 0.0 110.245 174.337 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -78.02 -61.17 2.08 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 167.641 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 60.02 93.74 0.05 OUTLIER Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 125.422 1.489 . . . . 0.0 112.321 177.601 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -72.03 -158.59 0.06 OUTLIER 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 122.775 2.317 . . . . 0.0 111.697 173.415 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -70.52 93.66 0.92 Allowed 'General case' 0 N--CA 1.481 1.096 0 CA-C-O 121.486 0.66 . . . . 0.0 110.76 -178.875 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -114.32 149.12 41.57 Favored Pre-proline 0 CA--C 1.541 0.598 0 C-N-CA 124.314 1.046 . . . . 0.0 108.433 174.448 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_exo -58.96 -51.92 6.01 Favored 'Trans proline' 0 C--N 1.373 1.821 0 C-N-CA 122.332 2.021 . . . . 0.0 110.915 171.188 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.1 t70 64.98 166.92 0.17 Allowed 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 125.046 1.339 . . . . 0.0 110.927 -178.118 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -87.53 -44.95 10.89 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.032 0.533 . . . . 0.0 110.872 178.557 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -176.34 -37.08 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.646 1.178 . . . . 0.0 110.414 179.246 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 55.5 t0 65.4 110.47 0.03 OUTLIER 'General case' 0 C--N 1.356 0.857 0 C-N-CA 125.482 1.513 . . . . 0.0 110.298 -167.178 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 21.5 ttp180 -134.4 5.15 3.46 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 124.575 1.15 . . . . 0.0 108.904 176.476 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -91.08 -29.67 17.19 Favored 'General case' 0 C--N 1.356 0.884 0 C-N-CA 123.481 0.713 . . . . 0.0 111.301 -176.687 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.6 p -70.32 88.33 0.64 Allowed 'General case' 0 C--N 1.36 1.027 0 CA-C-O 122.141 0.972 . . . . 0.0 110.392 177.389 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.61 ' HG3' ' HG3' ' A' ' 49' ' ' ARG . 7.6 pt-20 -96.16 -161.5 0.87 Allowed 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 113.951 -1.477 . . . . 0.0 109.664 177.185 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.61 ' HG3' ' HG3' ' A' ' 48' ' ' GLU . 95.3 mtt180 72.46 117.42 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 125.219 1.408 . . . . 0.0 111.724 173.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 34.8 p -83.7 116.21 22.55 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 169.386 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -68.59 96.32 0.7 Allowed 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.115 0.566 . . . . 0.0 111.263 -178.58 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -69.74 -35.97 75.45 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.103 172.741 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -66.41 131.83 46.94 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.277 171.281 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 33.8 t -91.49 -70.54 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 170.486 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.478 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 37.4 tp 61.84 106.57 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.594 1.158 . . . . 0.0 110.239 -177.2 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -68.14 13.23 0.09 Allowed 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 114.883 1.438 . . . . 0.0 114.883 -168.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -77.65 -2.61 36.84 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.051 0.54 . . . . 0.0 111.048 168.81 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 8.8 mt -72.93 136.06 45.14 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 170.5 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -70.3 149.08 46.68 Favored Glycine 0 N--CA 1.472 1.087 0 CA-C-O 119.227 -0.763 . . . . 0.0 112.45 -177.234 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -50.72 -60.31 3.18 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.725 1.21 . . . . 0.0 112.51 -175.269 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.43 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 12.4 p -56.81 -35.03 44.95 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 123.202 0.601 . . . . 0.0 111.377 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -67.86 -41.13 88.98 Favored Glycine 0 C--N 1.347 1.165 0 O-C-N 123.883 0.739 . . . . 0.0 112.665 177.383 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -68.87 -43.78 74.64 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.629 0.771 . . . . 0.0 110.695 -177.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -68.2 -33.09 73.78 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.588 0.755 . . . . 0.0 110.749 178.144 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.43 ' HB2' ' O ' ' A' ' 61' ' ' VAL . 2.7 tp10 -69.79 -46.75 65.05 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.609 179.608 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.7 mp -60.59 -39.44 88.1 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 124.356 1.035 . . . . 0.0 110.47 174.742 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 74.0 ttt180 -64.24 -39.61 94.31 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.311 -179.124 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.19 -43.11 65.02 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.921 0.889 . . . . 0.0 110.985 178.506 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.671 HG21 ' HB3' ' A' ' 20' ' ' GLN . 69.9 mt -64.5 -55.86 19.22 Favored 'Isoleucine or valine' 0 C--N 1.356 0.855 0 C-N-CA 123.507 0.723 . . . . 0.0 110.174 -177.845 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -66.71 -25.29 66.45 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.089 0.955 . . . . 0.0 112.304 -179.449 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.17 -51.93 58.09 Favored 'General case' 0 N--CA 1.482 1.175 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 171.07 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.525 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -60.43 -42.42 96.03 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.317 1.047 . . . . 0.0 111.007 -179.042 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.501 HD23 HD12 ' A' ' 76' ' ' ILE . 88.1 mt -64.19 -39.41 93.94 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 124.56 1.144 . . . . 0.0 111.619 178.537 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.12 -37.66 88.17 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.383 0.673 . . . . 0.0 110.558 175.502 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.407 HH12 HG21 ' A' ' 85' ' ' VAL . 69.6 mtt-85 -73.05 -26.44 61.29 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.701 0.8 . . . . 0.0 111.055 178.494 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.525 HG13 ' O ' ' A' ' 72' ' ' ALA . 90.0 mt -66.33 -48.76 79.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 174.915 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.62 -35.17 80.04 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.909 179.197 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.8 t -78.19 -14.94 59.25 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 123.794 0.837 . . . . 0.0 111.437 177.2 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 82.23 6.19 88.99 Favored Glycine 0 C--N 1.351 1.385 0 C-N-CA 123.24 0.448 . . . . 0.0 113.908 177.914 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.5 t -104.28 15.17 28.87 Favored 'General case' 0 CA--C 1.555 1.172 0 C-N-CA 124.311 1.045 . . . . 0.0 111.323 -177.308 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -67.16 151.85 46.81 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 169.795 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 72.29 20.58 79.3 Favored Glycine 0 C--N 1.344 1.009 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.775 -176.473 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 30.5 m -128.12 111.37 13.4 Favored 'General case' 0 C--N 1.353 0.742 0 C-N-CA 124.179 0.992 . . . . 0.0 109.65 178.516 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.444 ' HB2' HD13 ' A' ' 91' ' ' ILE . 44.2 t -72.71 93.18 1.62 Allowed 'General case' 0 C--O 1.244 0.769 0 C-N-CA 123.878 0.871 . . . . 0.0 110.094 173.13 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.407 HG21 HH12 ' A' ' 75' ' ' ARG . 25.6 m -61.07 -24.4 32.97 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 CA-C-N 114.438 -1.255 . . . . 0.0 112.843 -178.939 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 47.7 tttm -71.9 -14.79 62.04 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.055 0.542 . . . . 0.0 112.116 -176.204 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.467 ' SG ' ' HB2' ' A' ' 89' ' ' LYS . 27.7 p -137.11 5.57 2.79 Favored 'General case' 0 N--CA 1.486 1.374 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 173.322 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 65.04 17.2 63.07 Favored Glycine 0 C--N 1.357 1.728 0 N-CA-C 113.819 0.288 . . . . 0.0 113.819 -178.364 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.467 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 31.8 mmmt -101.34 165.19 11.4 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.756 0.822 . . . . 0.0 109.415 -179.028 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 25.6 mmt180 -80.41 149.6 30.1 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 123.001 0.521 . . . . 0.0 110.42 172.079 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.444 HD13 ' HB2' ' A' ' 84' ' ' CYS . 5.3 mm -78.16 145.62 9.5 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 172.558 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 17.2 m -75.21 151.39 38.45 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.127 0.571 . . . . 0.0 109.744 177.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -64.25 -41.06 97.12 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 122.624 0.37 . . . . 0.0 110.672 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.456 ' HA ' ' HG2' ' A' ' 97' ' ' LYS . 24.7 m-20 -71.44 -31.71 67.51 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 123.771 0.67 . . . . 0.0 111.213 -179.465 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.422 ' HE ' HG21 ' A' ' 102' ' ' THR . 29.0 tpt180 -64.02 -37.17 86.44 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.433 0.693 . . . . 0.0 110.588 170.906 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 55.6 mt -77.68 -40.91 39.96 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.175 0.59 . . . . 0.0 112.278 -178.484 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.456 ' HG2' ' HA ' ' A' ' 94' ' ' ASP . 15.2 ptpt -70.79 -27.61 64.04 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-O 120.757 0.313 . . . . 0.0 110.223 -177.295 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.7 -50.69 8.99 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.693 0.797 . . . . 0.0 110.755 173.234 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.411 ' O ' HG22 ' A' ' 102' ' ' THR . 0.5 OUTLIER -130.2 86.0 55.34 Favored Pre-proline 0 CA--C 1.558 1.275 0 C-N-CA 124.087 0.955 . . . . 0.0 108.724 -175.449 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -77.89 -7.15 16.37 Favored 'Trans proline' 0 C--N 1.37 1.707 0 C-N-CA 122.383 2.055 . . . . 0.0 114.077 -177.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 16.3 p90 -103.12 -8.63 20.34 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -176.567 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.422 HG21 ' HE ' ' A' ' 95' ' ' ARG . 15.1 t -73.5 125.28 90.74 Favored Pre-proline 0 CA--C 1.56 1.331 0 CA-C-N 117.896 0.316 . . . . 0.0 110.398 -175.546 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -79.15 -7.91 15.25 Favored 'Trans proline' 0 C--N 1.371 1.724 0 C-N-CA 122.517 2.145 . . . . 0.0 111.98 172.382 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -116.32 140.08 49.71 Favored 'General case' 0 C--N 1.353 0.723 0 C-N-CA 123.855 0.862 . . . . 0.0 110.281 -175.157 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 20.6 p -75.43 167.09 22.56 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 174.508 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -50.55 -41.49 54.19 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.798 0.839 . . . . 0.0 112.106 -174.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -65.48 -44.27 87.64 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.2 1.0 . . . . 0.0 110.396 -175.549 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.417 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 86.8 m -69.26 -39.34 78.49 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.23 0.612 . . . . 0.0 111.103 177.954 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.88 -30.99 71.68 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.576 0.75 . . . . 0.0 111.399 177.823 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -74.46 -34.69 63.21 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.893 0.877 . . . . 0.0 110.598 174.314 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -77.02 -14.38 59.84 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 123.881 0.872 . . . . 0.0 111.939 178.489 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 108' ' ' CYS . 94.5 mt . . . . . 0 N--CA 1.479 0.996 0 CA-C-O 118.237 -0.887 . . . . 0.0 109.426 172.214 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 7.4 mp . . . . . 0 N--CA 1.476 0.866 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 65.64 -88.16 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 125.258 1.423 . . . . 0.0 112.305 -179.394 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 72.99 -80.84 0.69 Allowed Glycine 0 C--N 1.346 1.131 0 N-CA-C 111.824 -0.51 . . . . 0.0 111.824 -173.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 70.64 -112.08 4.09 Favored Glycine 0 C--N 1.353 1.518 0 CA-C-O 119.692 -0.505 . . . . 0.0 112.932 178.391 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 65.6 mttm 63.32 -164.39 0.25 Allowed 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 124.977 1.311 . . . . 0.0 112.675 175.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.7 p -59.5 -32.51 70.35 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.079 0.951 . . . . 0.0 111.498 173.856 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 56.8 ttp -156.1 134.43 11.49 Favored 'General case' 0 C--O 1.242 0.676 0 C-N-CA 124.454 1.102 . . . . 0.0 108.282 176.156 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 15.9 p-10 -70.86 81.65 0.64 Allowed 'General case' 0 CA--C 1.548 0.874 0 CA-C-O 121.9 0.857 . . . . 0.0 110.273 176.577 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 42.5 t -69.69 -27.56 34.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.485 -179.302 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -52.98 -38.49 62.24 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.073 0.949 . . . . 0.0 111.695 179.399 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 16.6 m -60.42 -43.48 96.71 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.932 175.887 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.459 ' HA ' HG22 ' A' ' 15' ' ' ILE . 25.4 m-85 -72.18 -32.69 67.05 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.996 179.663 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.608 ' HG2' HD13 ' A' ' 76' ' ' ILE . 39.5 mt-10 -59.3 -56.25 24.44 Favored 'General case' 0 N--CA 1.492 1.636 0 CA-C-O 121.434 0.635 . . . . 0.0 110.809 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -66.47 -44.44 82.71 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.134 -176.01 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.459 HG22 ' HA ' ' A' ' 12' ' ' TYR . 10.3 tt -67.49 -32.7 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.242 0 C-N-CA 122.514 0.326 . . . . 0.0 110.574 -174.861 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.535 ' HB3' HG23 ' A' ' 69' ' ' ILE . 31.2 mt -65.2 -46.09 82.15 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.093 0.557 . . . . 0.0 110.635 175.103 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 51.2 mtm-85 -63.82 -41.91 97.77 Favored 'General case' 0 C--O 1.217 -0.628 0 O-C-N 123.605 0.566 . . . . 0.0 110.81 179.402 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -61.54 -36.27 80.1 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.317 0.647 . . . . 0.0 111.218 177.757 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -81.15 -28.84 34.89 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.258 -178.535 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.642 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.4 pt20 -78.04 -25.09 47.62 Favored 'General case' 0 C--O 1.207 -1.16 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 173.546 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 72.9 mtt180 -66.82 -49.48 65.67 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.056 0.542 . . . . 0.0 110.589 176.452 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -65.75 -37.46 86.42 Favored 'General case' 0 N--CA 1.478 0.968 0 O-C-N 123.533 0.521 . . . . 0.0 110.88 178.549 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.59 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 58.0 mt -67.96 -46.23 71.97 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 119.155 -0.45 . . . . 0.0 111.147 175.411 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.422 ' O ' ' HB2' ' A' ' 28' ' ' HIS . 3.8 m-85 -58.13 -50.53 73.18 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.173 0.589 . . . . 0.0 110.094 -177.579 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 19.7 ptt180 -68.79 -28.15 66.51 Favored 'General case' 0 N--CA 1.48 1.057 0 O-C-N 123.525 0.515 . . . . 0.0 111.172 -178.587 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.455 ' O ' ' HE3' ' A' ' 29' ' ' LYS . 14.8 ttm180 -62.97 -59.05 5.35 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.083 0.553 . . . . 0.0 110.403 175.882 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.59 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 1.6 pp -80.99 -8.37 59.76 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.986 -176.761 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.462 ' HB3' ' HG2' ' A' ' 31' ' ' GLU . 17.9 m170 -112.11 53.76 0.72 Allowed 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 170.83 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.455 ' HE3' ' O ' ' A' ' 26' ' ' ARG . 5.1 ptpp? -72.06 -19.59 61.8 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.012 -177.201 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.518 HD12 ' HG3' ' A' ' 57' ' ' GLU . 0.2 OUTLIER -61.87 -38.41 80.53 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.204 0.602 . . . . 0.0 111.525 175.421 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.462 ' HG2' ' HB3' ' A' ' 28' ' ' HIS . 12.7 pt-20 -94.4 -28.82 15.31 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.093 0.557 . . . . 0.0 110.32 178.261 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -89.02 75.36 7.98 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 122.002 0.906 . . . . 0.0 109.179 174.815 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -92.29 13.8 18.24 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 114.256 -1.338 . . . . 0.0 110.744 -177.026 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 27.1 t80 68.08 29.73 6.18 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 124.938 1.295 . . . . 0.0 109.871 -172.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -94.01 11.1 30.89 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.515 1.126 . . . . 0.0 109.827 169.852 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -64.53 155.16 82.23 Favored Pre-proline 0 CA--C 1.552 1.056 0 C-N-CA 125.422 1.489 . . . . 0.0 111.325 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.411 ' HG3' ' HB2' ' A' ' 44' ' ' ASP . 15.9 Cg_endo -54.77 123.77 14.56 Favored 'Trans proline' 0 C--N 1.382 2.292 0 C-N-CA 122.803 2.335 . . . . 0.0 112.116 177.653 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 42.0 mtp180 -65.92 -30.5 71.1 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.634 0.773 . . . . 0.0 111.24 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -78.99 118.71 74.01 Favored Pre-proline 0 CA--C 1.547 0.829 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 170.339 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -63.7 103.55 0.4 Allowed 'Trans proline' 0 C--N 1.378 2.099 0 C-N-CA 122.948 2.432 . . . . 0.0 112.714 -171.451 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -133.92 148.39 51.2 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 174.625 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 56.1 m-20 -83.08 -27.54 30.15 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.212 0.605 . . . . 0.0 112.139 -172.314 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -125.3 -30.7 3.12 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.387 0.675 . . . . 0.0 111.546 -171.943 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.411 ' HB2' ' HG3' ' A' ' 37' ' ' PRO . 24.5 t70 58.23 -84.68 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.562 1.145 . . . . 0.0 110.721 -171.813 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 42.7 ttp180 171.83 71.33 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.297 1.839 . . . . 0.0 106.295 177.466 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -159.06 90.06 0.96 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.073 -177.484 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 31.4 p -151.43 -61.93 0.18 Allowed 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 175.333 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.552 ' HG2' ' HG3' ' A' ' 49' ' ' ARG . 28.9 tt0 64.39 -81.88 0.03 OUTLIER 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 124.811 1.244 . . . . 0.0 112.32 172.717 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.552 ' HG3' ' HG2' ' A' ' 48' ' ' GLU . 24.5 mtp180 -130.42 -174.18 3.27 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 124.327 1.051 . . . . 0.0 110.66 -173.772 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 27.6 m -66.0 124.78 23.47 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 123.884 0.873 . . . . 0.0 112.037 -176.036 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -131.95 107.4 8.67 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.162 0.985 . . . . 0.0 108.845 174.549 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -118.56 70.76 0.82 Allowed 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 178.375 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -99.64 103.51 15.21 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.13 176.166 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 97.6 t -77.37 -71.27 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 173.046 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 96.1 mt 75.34 164.87 0.27 Allowed 'General case' 0 N--CA 1.489 1.525 0 C-N-CA 125.761 1.624 . . . . 0.0 112.05 -174.359 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -92.55 17.29 10.33 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 122.431 1.11 . . . . 0.0 109.392 170.046 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.518 ' HG3' HD12 ' A' ' 30' ' ' ILE . 0.6 OUTLIER -83.97 -13.01 54.42 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 126.203 1.801 . . . . 0.0 110.164 -175.207 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.535 HD22 HD13 ' A' ' 27' ' ' LEU . 4.6 mt -94.38 160.83 14.49 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.402 -165.51 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -97.53 161.71 21.36 Favored Glycine 0 N--CA 1.478 1.452 0 CA-C-O 119.493 -0.615 . . . . 0.0 112.181 173.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -64.77 -64.3 0.91 Allowed 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.231 0.612 . . . . 0.0 111.722 -173.145 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 9.3 p -59.32 -29.76 42.64 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 C-N-CA 123.89 0.876 . . . . 0.0 110.726 177.618 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.522 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -60.45 -51.73 56.96 Favored Glycine 0 C--N 1.348 1.25 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.164 175.956 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -69.9 -40.72 75.45 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.714 0.806 . . . . 0.0 112.024 -177.307 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -67.04 -44.05 81.19 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 123.92 0.763 . . . . 0.0 110.264 -174.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -70.43 -38.44 74.57 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.235 177.277 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.554 HD22 HD21 ' A' ' 27' ' ' LEU . 14.9 tp -58.23 -46.26 86.22 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 124.738 1.215 . . . . 0.0 111.137 178.525 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 31.1 ttt180 -75.94 -31.84 59.28 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 114.004 -1.453 . . . . 0.0 110.024 -175.054 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -68.28 -39.35 82.17 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 123.915 0.759 . . . . 0.0 110.717 174.533 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.642 HG21 ' HB3' ' A' ' 20' ' ' GLN . 80.9 mt -63.51 -47.7 90.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.523 0.729 . . . . 0.0 109.569 175.46 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -63.37 -35.59 80.91 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.813 -179.07 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.15 -39.99 75.02 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.757 0.823 . . . . 0.0 110.971 177.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.498 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -68.1 -43.3 78.78 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.61 0.764 . . . . 0.0 110.746 -179.699 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 84.7 mt -61.38 -39.11 89.46 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.288 1.035 . . . . 0.0 111.164 175.824 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.61 -37.12 86.49 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.624 175.746 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 67.3 mtt85 -69.98 -29.04 66.03 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.599 0.76 . . . . 0.0 111.509 176.701 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.608 HD13 ' HG2' ' A' ' 13' ' ' GLU . 62.3 mt -70.3 -44.79 77.3 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 177.394 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.89 -27.41 67.48 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 115.329 -0.851 . . . . 0.0 111.218 176.513 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.9 t -84.13 -18.23 37.46 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.729 0.812 . . . . 0.0 110.804 174.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 82.42 7.94 86.91 Favored Glycine 0 C--N 1.348 1.229 0 C-N-CA 123.084 0.373 . . . . 0.0 113.937 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.2 t -112.95 31.32 6.49 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 124.196 0.998 . . . . 0.0 110.402 -179.029 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -64.5 146.55 54.39 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.714 170.509 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.478 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 73.16 37.03 55.76 Favored Glycine 0 C--N 1.343 0.933 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.955 -177.933 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 41.0 m -121.73 116.27 24.21 Favored 'General case' 0 C--O 1.242 0.679 0 C-N-CA 123.279 0.632 . . . . 0.0 109.668 177.782 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 44.4 t -67.33 102.29 1.07 Allowed 'General case' 0 C--N 1.349 0.563 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 169.076 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 33.7 m -63.43 -30.28 49.39 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 O-C-N 124.242 0.964 . . . . 0.0 111.947 -177.802 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -73.66 -13.7 61.03 Favored 'General case' 0 CA--C 1.557 1.241 0 C-N-CA 123.609 0.763 . . . . 0.0 111.432 177.551 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 57.5 m -111.17 -23.29 10.96 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.768 0.827 . . . . 0.0 111.534 175.038 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 64.56 20.87 66.34 Favored Glycine 0 CA--C 1.537 1.464 0 CA-C-N 116.545 -0.298 . . . . 0.0 112.986 -165.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 46.6 mtmt -126.89 -177.56 4.07 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.978 0.911 . . . . 0.0 110.491 -172.368 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.478 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 18.7 tpp180 -72.9 152.67 41.34 Favored 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 124.663 1.185 . . . . 0.0 111.658 -178.192 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 17.6 mm -92.72 149.68 4.11 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.017 0 C-N-CA 124.978 1.311 . . . . 0.0 109.406 170.371 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.3 m -64.59 145.13 56.61 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 122.965 0.506 . . . . 0.0 110.25 174.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -58.5 -42.81 88.51 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.257 0.623 . . . . 0.0 110.839 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.501 ' HA ' ' HG2' ' A' ' 97' ' ' LYS . 16.2 m-20 -68.31 -33.11 73.73 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.83 -179.659 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.409 ' HG3' HG21 ' A' ' 102' ' ' THR . 24.6 tpt180 -68.35 -31.78 71.42 Favored 'General case' 0 CA--C 1.547 0.864 0 O-C-N 123.635 0.584 . . . . 0.0 110.217 173.785 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.41 HD21 ' HA2' ' A' ' 82' ' ' GLY . 90.9 mt -80.34 -37.06 33.21 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 118.189 0.45 . . . . 0.0 112.171 179.447 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.501 ' HG2' ' HA ' ' A' ' 94' ' ' ASP . 16.5 ptpt -75.32 -28.66 59.74 Favored 'General case' 0 N--CA 1.485 1.296 0 CA-C-O 120.882 0.373 . . . . 0.0 110.077 -177.514 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -91.37 -41.37 10.94 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.721 0.809 . . . . 0.0 111.296 178.736 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 3.8 t -132.54 76.04 72.49 Favored Pre-proline 0 CA--C 1.56 1.357 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 -175.516 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -74.02 0.9 7.77 Favored 'Trans proline' 0 C--N 1.373 1.84 0 C-N-CA 122.579 2.186 . . . . 0.0 114.123 -174.001 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 22.8 p90 -108.18 -8.61 15.72 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.445 0.698 . . . . 0.0 112.599 -176.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.409 HG21 ' HG3' ' A' ' 95' ' ' ARG . 14.7 t -65.62 123.18 83.91 Favored Pre-proline 0 CA--C 1.566 1.578 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -170.906 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -76.47 -19.23 15.05 Favored 'Trans proline' 0 C--N 1.377 2.05 0 C-N-CA 122.482 2.121 . . . . 0.0 112.041 171.255 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.401 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 6.9 m-85 -113.02 162.93 15.32 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.848 0.859 . . . . 0.0 109.766 -176.191 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 31.1 p -92.32 168.38 11.35 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 175.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -55.13 -32.46 62.09 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.618 0.767 . . . . 0.0 111.905 -178.72 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -67.74 -45.29 75.4 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.757 0.823 . . . . 0.0 109.917 178.856 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.401 ' HB2' ' HB3' ' A' ' 104' ' ' PHE . 91.6 m -69.65 -30.61 68.34 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.411 177.822 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.0 -32.4 74.1 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.419 0.688 . . . . 0.0 110.772 173.824 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -80.79 -21.16 41.2 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.588 0.755 . . . . 0.0 111.3 173.799 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -105.06 21.38 17.2 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.745 0.818 . . . . 0.0 112.47 -178.718 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 90.3 mt . . . . . 0 N--CA 1.484 1.261 0 C-N-CA 123.28 0.632 . . . . 0.0 109.997 175.324 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 6.6 mp . . . . . 0 N--CA 1.481 1.091 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -86.66 128.5 35.01 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.173 0.589 . . . . 0.0 109.886 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -170.98 169.16 42.25 Favored Glycine 0 C--N 1.346 1.1 0 O-C-N 123.071 0.232 . . . . 0.0 112.832 178.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 79.32 27.47 55.22 Favored Glycine 0 C--N 1.345 1.063 0 CA-C-O 119.718 -0.49 . . . . 0.0 114.09 175.144 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -75.67 -56.56 4.57 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 117.539 0.669 . . . . 0.0 109.341 172.688 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 26.7 m -102.98 -60.59 1.52 Allowed 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 168.742 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 89.5 mtp -148.18 -53.81 0.2 Allowed 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.701 1.2 . . . . 0.0 108.257 174.409 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 16.4 m120 59.77 77.09 0.33 Allowed 'General case' 0 C--N 1.352 0.712 0 C-N-CA 124.788 1.235 . . . . 0.0 109.054 -168.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 44.3 t -65.24 -26.04 38.71 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-N 114.35 -1.295 . . . . 0.0 111.795 -170.391 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -61.87 -31.02 71.26 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.351 0.66 . . . . 0.0 112.572 179.353 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.4 m -66.96 -40.24 87.44 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 121.395 0.617 . . . . 0.0 109.869 172.528 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -72.64 -30.24 64.14 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.749 178.74 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.529 ' HG2' HD13 ' A' ' 76' ' ' ILE . 41.2 mt-10 -66.49 -52.44 45.97 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 122.95 0.5 . . . . 0.0 110.385 -179.254 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -65.39 -41.56 93.58 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 123.938 0.774 . . . . 0.0 111.687 -176.712 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 12.0 tt -65.0 -34.82 73.2 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 CA-C-O 120.727 0.298 . . . . 0.0 110.281 -178.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.5 mt -69.24 -38.26 78.4 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 122.77 0.428 . . . . 0.0 111.119 176.161 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -58.83 -50.41 74.09 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.005 0.522 . . . . 0.0 110.268 175.276 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -61.35 -47.9 83.76 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.451 0.7 . . . . 0.0 111.669 -179.574 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.77 -40.69 98.08 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.452 0.701 . . . . 0.0 111.404 -178.203 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.666 ' HB3' HG21 ' A' ' 69' ' ' ILE . 3.0 pt20 -76.05 -32.34 59.26 Favored 'General case' 0 C--O 1.214 -0.815 0 CA-C-O 119.045 -0.502 . . . . 0.0 111.432 -177.698 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.0 mmt180 -76.24 -36.01 58.71 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 117.97 0.35 . . . . 0.0 111.365 -176.024 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -67.93 -41.19 82.96 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 174.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.51 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 75.6 mt -65.5 -43.02 91.47 Favored 'General case' 0 C--N 1.354 0.78 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.391 174.39 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -58.36 -54.0 51.98 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.862 0.865 . . . . 0.0 110.702 -175.561 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.9 ptt180 -69.11 -27.61 65.73 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 123.742 0.651 . . . . 0.0 111.224 -178.423 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 44.0 ttt85 -66.23 -58.32 5.65 Favored 'General case' 0 C--N 1.362 1.11 0 C-N-CA 122.919 0.488 . . . . 0.0 111.269 176.363 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.638 HD21 HD22 ' A' ' 66' ' ' LEU . 4.0 pp -72.76 -26.52 61.58 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 122.86 0.464 . . . . 0.0 111.022 -175.611 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 42.9 m-70 -84.8 31.75 0.53 Allowed 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.095 0.558 . . . . 0.0 111.376 173.012 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 17.9 pttp -57.45 -18.2 17.15 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 124.414 1.086 . . . . 0.0 113.646 175.46 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.528 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -64.33 -43.67 97.16 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 CA-C-O 118.907 -0.568 . . . . 0.0 112.294 177.653 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -119.12 -22.9 7.01 Favored 'General case' 0 N--CA 1.499 2.003 0 CA-C-N 119.185 0.902 . . . . 0.0 112.385 -179.473 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -84.55 138.46 32.74 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 122.73 0.412 . . . . 0.0 110.295 -177.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -125.81 155.95 40.31 Favored 'General case' 0 C--O 1.241 0.658 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.7 174.196 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -127.74 45.75 2.68 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 167.466 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -63.59 -44.18 94.79 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 114.863 -1.062 . . . . 0.0 109.668 178.106 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -92.78 130.91 35.05 Favored Pre-proline 0 CA--C 1.551 0.985 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.659 173.649 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -65.35 94.1 0.24 Allowed 'Trans proline' 0 C--N 1.376 1.986 0 C-N-CA 123.307 2.671 . . . . 0.0 112.247 174.804 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.8 mmm180 -89.36 148.48 23.49 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 173.463 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.593 ' HB2' ' HB2' ' A' ' 42' ' ' ASP . 62.7 m-20 -73.74 160.01 83.05 Favored Pre-proline 0 CA--C 1.56 1.346 0 C-N-CA 123.169 0.588 . . . . 0.0 110.102 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -54.09 -49.37 17.28 Favored 'Trans proline' 0 C--N 1.383 2.37 0 C-N-CA 123.009 2.473 . . . . 0.0 113.179 -178.413 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -103.42 18.31 22.1 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 115.0 -1.0 . . . . 0.0 111.278 -178.315 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.593 ' HB2' ' HB2' ' A' ' 39' ' ' ASN . 22.0 t70 -60.08 -33.0 71.48 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 123.658 0.783 . . . . 0.0 110.834 178.627 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -56.44 -26.31 53.26 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.138 0.975 . . . . 0.0 111.843 175.564 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 25.2 t70 66.41 -80.6 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.086 1.355 . . . . 0.0 109.831 -179.651 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 18.5 ttm180 -149.24 51.87 0.96 Allowed 'General case' 0 C--O 1.238 0.497 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 174.237 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.64 127.79 33.79 Favored 'General case' 0 C--O 1.246 0.897 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.182 178.156 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.8 p -53.93 110.66 0.62 Allowed 'General case' 0 CA--C 1.548 0.874 0 O-C-N 124.261 0.975 . . . . 0.0 110.39 -178.738 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -72.19 98.03 2.07 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.57 0.748 . . . . 0.0 109.218 -173.017 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -62.53 112.25 2.39 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 114.48 -1.236 . . . . 0.0 112.091 -167.008 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.2 m -72.08 122.33 20.76 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.248 1.019 . . . . 0.0 110.702 -176.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -113.28 109.74 19.23 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 175.169 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -73.32 -23.15 60.22 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.113 0.965 . . . . 0.0 111.641 -175.231 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -93.57 148.78 21.78 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.546 0.739 . . . . 0.0 109.928 178.302 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 59.4 t -68.52 -49.44 65.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 O-C-N 123.758 0.661 . . . . 0.0 109.654 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 40.6 tp 65.49 109.7 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 124.868 1.267 . . . . 0.0 111.632 178.176 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -67.41 -19.56 65.41 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.117 0.967 . . . . 0.0 111.735 -177.834 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -74.56 -8.26 55.78 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.357 0.663 . . . . 0.0 112.55 -177.561 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.447 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 59.8 mt -77.73 -73.36 0.31 Allowed 'General case' 0 CA--C 1.546 0.82 0 O-C-N 123.087 0.242 . . . . 0.0 110.597 178.355 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 129.7 124.7 2.65 Favored Glycine 0 N--CA 1.474 1.227 0 N-CA-C 111.375 -0.69 . . . . 0.0 111.375 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -66.05 -38.19 87.73 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -164.765 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 6.1 p -62.36 -39.4 84.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 CA-C-N 118.399 0.545 . . . . 0.0 110.692 177.741 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.481 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -66.39 -49.89 53.66 Favored Glycine 0 C--N 1.344 0.98 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.632 176.463 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -67.23 -35.72 80.14 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 124.593 1.157 . . . . 0.0 112.24 -174.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -73.11 -48.69 33.52 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.577 -176.063 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -64.96 -34.57 78.73 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 115.013 -0.994 . . . . 0.0 109.74 177.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.638 HD22 HD21 ' A' ' 27' ' ' LEU . 13.9 tp -60.84 -46.02 92.23 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.691 1.197 . . . . 0.0 109.911 175.517 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 51.7 ttt180 -61.92 -38.09 87.12 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.172 0.989 . . . . 0.0 110.93 -178.469 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.16 -43.26 99.17 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 123.81 0.694 . . . . 0.0 110.253 176.093 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.666 HG21 ' HB3' ' A' ' 20' ' ' GLN . 85.1 mt -65.2 -45.49 93.69 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.871 179.076 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -66.14 -33.09 74.98 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.912 0.885 . . . . 0.0 111.123 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.58 -35.89 73.28 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.093 0.957 . . . . 0.0 110.243 177.192 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.431 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -68.44 -47.28 67.59 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.64 177.348 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.505 HD23 HD12 ' A' ' 76' ' ' ILE . 88.2 mt -63.24 -33.76 76.19 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 124.192 0.997 . . . . 0.0 111.491 177.115 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.0 -41.24 95.57 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.667 0.787 . . . . 0.0 110.355 175.702 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 89.1 mtm180 -68.82 -30.43 68.97 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.382 0.673 . . . . 0.0 111.604 176.365 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.529 HD13 ' HG2' ' A' ' 13' ' ' GLU . 75.1 mt -68.99 -42.63 82.22 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 176.499 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.53 -34.25 77.81 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.767 176.28 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.8 t -82.0 -12.79 58.14 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 124.035 0.934 . . . . 0.0 111.114 178.268 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 75.71 9.64 84.88 Favored Glycine 0 C--N 1.353 1.521 0 C-N-CA 123.086 0.375 . . . . 0.0 113.627 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 15.2 t -112.42 28.18 9.0 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.24 1.016 . . . . 0.0 109.774 -177.915 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -66.45 144.41 56.51 Favored 'General case' 0 C--N 1.348 0.527 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.901 172.291 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.585 ' HA2' HD21 ' A' ' 96' ' ' LEU . . . 77.87 37.27 30.12 Favored Glycine 0 C--N 1.34 0.77 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.769 -172.256 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 93.9 m -123.79 118.26 26.77 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.557 0.743 . . . . 0.0 110.586 177.181 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 48.8 t -62.02 92.85 0.04 OUTLIER 'General case' 0 C--N 1.352 0.699 0 C-N-CA 124.927 1.291 . . . . 0.0 108.239 166.725 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 33.1 m -62.88 -27.33 42.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 124.003 0.921 . . . . 0.0 112.25 -173.211 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.676 ' HE3' ' HA ' ' A' ' 112' ' ' LEU . 59.4 tttm -70.48 -20.63 62.85 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.25 1.02 . . . . 0.0 111.573 178.681 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 11.8 m -120.48 -13.54 8.79 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 123.959 0.903 . . . . 0.0 111.342 -174.172 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 60.83 31.6 76.42 Favored Glycine 0 C--N 1.353 1.473 0 CA-C-N 116.48 -0.327 . . . . 0.0 113.266 -173.742 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -135.74 -174.49 3.67 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.761 0.824 . . . . 0.0 110.691 -176.422 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.471 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 4.3 tpp180 -74.7 151.93 39.17 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.854 0.862 . . . . 0.0 112.918 -169.885 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 23.9 mm -95.48 148.85 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 124.345 1.058 . . . . 0.0 108.513 167.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.4 m -71.75 145.46 48.74 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.643 0.777 . . . . 0.0 110.05 177.578 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -58.32 -41.03 83.65 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.245 0.618 . . . . 0.0 110.929 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -62.55 -38.97 92.11 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.324 1.05 . . . . 0.0 111.101 179.318 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.447 ' HE ' HG21 ' A' ' 102' ' ' THR . 25.5 tpt180 -69.66 -33.46 72.62 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.74 178.604 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.585 HD21 ' HA2' ' A' ' 82' ' ' GLY . 87.0 mt -73.17 -45.23 57.77 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 122.817 0.447 . . . . 0.0 111.421 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -71.32 -28.46 64.11 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 122.808 0.443 . . . . 0.0 110.938 -175.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -88.34 -47.16 8.6 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.336 0.654 . . . . 0.0 111.058 178.517 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 1.7 t -129.87 79.66 72.81 Favored Pre-proline 0 CA--C 1.559 1.308 0 C-N-CA 124.029 0.931 . . . . 0.0 108.639 -175.84 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -73.37 -8.17 21.45 Favored 'Trans proline' 0 C--N 1.372 1.774 0 C-N-CA 122.285 1.99 . . . . 0.0 113.445 -177.401 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 26.6 p90 -100.86 -8.69 22.35 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -176.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.447 HG21 ' HE ' ' A' ' 95' ' ' ARG . 13.8 t -62.06 122.17 70.57 Favored Pre-proline 0 CA--C 1.563 1.443 0 O-C-N 123.129 0.268 . . . . 0.0 111.365 -172.152 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -66.44 -37.85 21.75 Favored 'Trans proline' 0 C--N 1.376 2.026 0 C-N-CA 122.461 2.107 . . . . 0.0 111.371 173.411 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -99.57 -179.49 4.22 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.694 -178.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.732 ' SG ' ' HB2' ' A' ' 108' ' ' CYS . 15.0 p -98.71 179.64 4.6 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 124.875 1.27 . . . . 0.0 109.227 173.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -64.86 -55.51 19.04 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 118.051 0.387 . . . . 0.0 111.459 -177.348 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.06 -34.25 76.08 Favored 'General case' 0 N--CA 1.483 1.225 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -175.068 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.732 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 68.3 m -81.04 -22.95 38.91 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 179.433 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -78.74 -24.23 44.94 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 171.439 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -81.87 -27.4 33.5 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.605 0.762 . . . . 0.0 110.797 172.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -131.51 78.19 1.81 Allowed 'General case' 0 C--O 1.242 0.677 0 C-N-CA 124.137 0.975 . . . . 0.0 109.959 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.676 ' HA ' ' HE3' ' A' ' 86' ' ' LYS . 73.7 mt . . . . . 0 CA--C 1.551 1.017 0 CA-C-N 114.677 -1.147 . . . . 0.0 109.89 175.68 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 41.8 t30 . . . . . 0 N--CA 1.479 1.017 0 CA-C-O 120.621 0.248 . . . . 0.0 110.837 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 59.8 t -59.25 -35.7 59.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 124.039 0.936 . . . . 0.0 112.113 -174.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -56.51 -43.31 79.64 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.361 0.664 . . . . 0.0 111.601 -174.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.8 m -58.17 -43.8 87.65 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 123.989 0.806 . . . . 0.0 110.798 178.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.518 ' HA ' HG22 ' A' ' 15' ' ' ILE . 36.6 m-85 -74.24 -37.22 63.86 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.989 -176.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -57.59 -51.31 70.0 Favored 'General case' 0 C--O 1.244 0.802 0 C-N-CA 124.823 1.249 . . . . 0.0 110.497 -177.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.415 ' NZ ' ' HB2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -71.49 -42.45 68.03 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.276 -0.875 . . . . 0.0 111.568 -177.661 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.518 HG22 ' HA ' ' A' ' 12' ' ' TYR . 9.2 tt -67.68 -28.52 42.02 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 CA-C-N 118.474 0.579 . . . . 0.0 110.723 -177.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 42.1 mt -63.12 -47.41 82.93 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.299 0.64 . . . . 0.0 110.27 172.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.52 ' O ' ' HG3' ' A' ' 21' ' ' ARG . 48.2 mtm105 -62.57 -42.56 99.62 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 123.953 0.783 . . . . 0.0 111.229 176.186 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -59.74 -45.4 92.31 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 122.889 0.476 . . . . 0.0 110.198 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? -67.28 -42.11 84.34 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.776 -177.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.67 ' HB3' HG21 ' A' ' 69' ' ' ILE . 3.2 pt20 -71.13 -36.0 71.93 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-O 118.82 -0.609 . . . . 0.0 110.531 -174.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.52 ' HG3' ' O ' ' A' ' 17' ' ' ARG . 53.7 mtp180 -75.67 -39.6 57.33 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 123.791 0.682 . . . . 0.0 111.934 -173.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -64.2 -40.02 95.2 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 123.459 0.475 . . . . 0.0 109.869 174.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.508 ' HB2' HD11 ' A' ' 66' ' ' LEU . 98.8 mt -72.78 -29.82 63.6 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.44 175.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.434 ' HB2' ' HA ' ' A' ' 21' ' ' ARG . 1.4 m-85 -65.5 -54.79 23.29 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.478 0.711 . . . . 0.0 109.498 178.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -66.35 -27.29 67.77 Favored 'General case' 0 N--CA 1.482 1.164 0 O-C-N 123.939 0.774 . . . . 0.0 110.758 -177.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -58.77 -52.76 64.35 Favored 'General case' 0 C--N 1.356 0.882 0 O-C-N 124.077 0.86 . . . . 0.0 110.695 173.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 3.2 pp -87.32 -11.79 48.43 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 31.0 m170 . . . . . 0 N--CA 1.491 1.606 0 C-N-CA 123.866 0.866 . . . . 0.0 110.835 175.704 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.501 ' HB2' ' NE2' ' A' ' 63' ' ' GLN . 18.1 mt . . . . . 0 C--O 1.241 0.628 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -59.4 124.98 38.15 Favored Glycine 0 C--N 1.353 1.492 0 CA-C-O 118.808 -0.995 . . . . 0.0 111.521 177.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -62.49 -32.71 73.66 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 123.552 0.741 . . . . 0.0 112.22 -174.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.434 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 8.7 p -62.84 -39.04 83.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 123.251 0.62 . . . . 0.0 110.156 174.318 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -73.23 -43.11 40.3 Favored Glycine 0 C--N 1.348 1.198 0 O-C-N 123.686 0.616 . . . . 0.0 111.969 179.121 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.501 ' NE2' ' HB2' ' A' ' 58' ' ' LEU . 99.4 mt-30 -59.89 -45.34 92.84 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.028 0.931 . . . . 0.0 110.725 177.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -67.7 -40.57 84.31 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.121 0.968 . . . . 0.0 110.474 -178.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.434 ' HB2' ' O ' ' A' ' 61' ' ' VAL . 3.1 tp10 -65.15 -42.1 94.1 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.624 178.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.508 HD11 ' HB2' ' A' ' 23' ' ' LEU . 0.8 OUTLIER -70.31 -29.97 66.84 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.693 1.197 . . . . 0.0 111.35 179.927 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 41.9 ttt180 -69.4 -38.69 78.07 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 123.856 0.722 . . . . 0.0 109.665 175.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.85 -37.55 76.17 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.675 0.79 . . . . 0.0 111.038 177.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.67 HG21 ' HB3' ' A' ' 20' ' ' GLN . 98.7 mt -68.95 -40.29 80.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 123.61 0.764 . . . . 0.0 110.016 175.303 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -66.74 -39.21 87.86 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.7 0.8 . . . . 0.0 110.17 -178.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.58 -41.85 92.42 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.632 0.773 . . . . 0.0 110.493 176.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.433 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -65.28 -45.82 82.9 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.874 0.869 . . . . 0.0 111.186 179.463 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.498 HD23 HD12 ' A' ' 76' ' ' ILE . 80.5 mt -65.53 -31.99 73.34 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.161 0.984 . . . . 0.0 111.222 177.278 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.6 -34.07 69.56 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.479 0.712 . . . . 0.0 110.951 177.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -65.38 -36.19 83.22 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.006 0.522 . . . . 0.0 110.213 172.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.498 HD12 HD23 ' A' ' 73' ' ' LEU . 55.8 mt -66.68 -43.7 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 177.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.83 -30.44 71.49 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.533 1.133 . . . . 0.0 111.539 175.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.9 t -85.07 -17.27 37.92 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.833 0.853 . . . . 0.0 111.115 177.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 82.15 13.29 79.37 Favored Glycine 0 C--N 1.347 1.188 0 C-N-CA 123.412 0.53 . . . . 0.0 113.549 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 12.4 t -125.14 33.39 5.18 Favored 'General case' 0 CA--C 1.556 1.18 0 C-N-CA 124.176 0.99 . . . . 0.0 110.718 -177.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -62.84 144.32 56.72 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 121.91 -0.494 . . . . 0.0 110.087 165.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.21 31.06 32.34 Favored Glycine 0 C--N 1.341 0.848 0 O-C-N 123.965 0.791 . . . . 0.0 111.359 -171.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.7 m -130.46 114.55 15.67 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.717 0.807 . . . . 0.0 110.203 175.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 44.1 t -61.13 106.16 0.57 Allowed 'General case' 0 C--N 1.351 0.667 0 C-N-CA 124.101 0.96 . . . . 0.0 109.131 170.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 26.8 m -59.09 -31.01 44.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 O-C-N 124.236 0.96 . . . . 0.0 110.995 177.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 36.0 tttm -80.22 -7.56 59.04 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.084 0.953 . . . . 0.0 111.624 -176.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 62.8 m -119.83 -24.25 6.2 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 124.023 0.929 . . . . 0.0 111.91 174.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 65.04 27.8 72.74 Favored Glycine 0 CA--C 1.537 1.461 0 O-C-N 123.423 0.452 . . . . 0.0 112.103 -165.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -134.42 172.94 12.2 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.747 0.819 . . . . 0.0 110.133 -171.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.54 151.71 44.77 Favored 'General case' 0 CA--C 1.573 1.838 0 C-N-CA 124.377 1.071 . . . . 0.0 111.468 -172.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 8.7 mm -99.21 152.09 4.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 C-N-CA 125.237 1.415 . . . . 0.0 109.807 174.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.1 m -72.33 142.76 48.82 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 122.985 0.514 . . . . 0.0 109.737 173.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 46.2 tt0 -66.47 -32.14 73.32 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.866 0.466 . . . . 0.0 110.211 175.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.434 ' HA ' ' HE3' ' A' ' 97' ' ' LYS . 35.7 m-20 -66.83 -34.95 78.94 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.737 0.815 . . . . 0.0 111.393 175.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -60.77 -45.15 95.46 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 123.948 0.78 . . . . 0.0 110.297 173.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 98.3 mt -81.64 -27.25 34.21 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 -173.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.434 ' HE3' ' HA ' ' A' ' 94' ' ' ASP . 16.9 ptpt -73.69 -31.39 63.41 Favored 'General case' 0 N--CA 1.483 1.207 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 177.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.44 -43.36 19.01 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.769 0.828 . . . . 0.0 110.838 176.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.2 p -150.18 94.88 3.67 Favored Pre-proline 0 CA--C 1.556 1.179 0 C-N-CA 124.477 1.111 . . . . 0.0 109.325 -178.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -76.05 -10.14 19.47 Favored 'Trans proline' 0 C--N 1.379 2.173 0 C-N-CA 122.574 2.183 . . . . 0.0 112.967 177.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . 0.42 ' HB3' HG12 ' A' ' 69' ' ' ILE . 15.3 p90 -101.8 48.91 0.87 Allowed 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.835 0.854 . . . . 0.0 110.545 -176.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 10.1 t -129.77 116.22 18.13 Favored Pre-proline 0 CA--C 1.55 0.968 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.383 171.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -76.16 -0.06 9.91 Favored 'Trans proline' 0 C--N 1.372 1.792 0 C-N-CA 122.348 2.032 . . . . 0.0 111.933 170.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.427 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 9.6 m-85 -115.56 146.36 41.81 Favored 'General case' 0 C--N 1.351 0.668 0 C-N-CA 123.974 0.909 . . . . 0.0 109.39 -176.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.418 ' SG ' ' HB2' ' A' ' 107' ' ' GLU . 23.4 p -77.11 162.87 27.12 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 172.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -59.87 -29.95 68.66 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 118.21 0.459 . . . . 0.0 111.881 -174.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 0.418 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 33.7 mt-10 -55.55 -52.3 64.18 Favored 'General case' 0 N--CA 1.481 1.101 0 O-C-N 123.986 0.804 . . . . 0.0 110.586 171.437 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.427 ' HB2' ' HB3' ' A' ' 104' ' ' PHE . 93.2 m -68.53 -39.59 81.1 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.278 178.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -63.43 -36.63 84.36 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.774 0.83 . . . . 0.0 111.115 -177.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -81.24 -22.36 38.79 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.71 0.804 . . . . 0.0 110.865 177.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.948 0 C-N-CA 123.838 0.855 . . . . 0.0 112.367 178.414 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 . . . . . 0 N--CA 1.477 0.88 0 CA-C-O 121.754 0.788 . . . . 0.0 110.329 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 49.2 t -77.58 -26.49 15.17 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-N 114.878 -1.056 . . . . 0.0 110.605 -177.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -67.06 -33.4 75.44 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.31 0.644 . . . . 0.0 110.759 178.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.8 m -61.94 -43.37 98.98 Favored 'General case' 0 C--O 1.243 0.732 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.378 172.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.449 ' HA ' HG22 ' A' ' 15' ' ' ILE . 22.6 m-85 -68.61 -37.97 80.19 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 114.941 -1.027 . . . . 0.0 110.585 177.414 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.488 ' HG2' HG21 ' A' ' 76' ' ' ILE . 2.5 tm-20 -56.47 -55.39 34.27 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 125.218 1.407 . . . . 0.0 110.302 -175.21 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.1 -45.03 78.46 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.79 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.457 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 12.5 tt -65.22 -31.63 54.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 CA-C-N 118.099 0.409 . . . . 0.0 110.847 -174.242 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.536 ' HB3' HG23 ' A' ' 69' ' ' ILE . 60.1 mt -64.57 -44.38 90.89 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.516 0.726 . . . . 0.0 110.449 174.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 53.1 mtt180 -63.44 -39.77 95.37 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 123.864 0.728 . . . . 0.0 111.357 177.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -65.93 -44.21 85.78 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.899 0.479 . . . . 0.0 110.473 -177.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.457 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -66.38 -43.58 85.5 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.893 178.276 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.65 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.0 pt20 -70.14 -29.41 66.32 Favored 'General case' 0 C--O 1.207 -1.171 0 CA-C-O 118.608 -0.711 . . . . 0.0 110.707 -177.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 87.5 mtt180 -74.93 -44.58 47.8 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.704 0.802 . . . . 0.0 112.114 -177.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -62.62 -43.37 98.99 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-O 121.371 0.605 . . . . 0.0 109.703 177.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.592 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 86.6 mt -70.59 -33.84 71.52 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 114.918 -1.037 . . . . 0.0 110.417 176.469 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.49 ' O ' ' HB2' ' A' ' 28' ' ' HIS . 0.2 OUTLIER -59.93 -56.62 19.42 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.285 0.634 . . . . 0.0 109.586 -177.917 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 20.4 ptt180 -64.62 -30.36 71.38 Favored 'General case' 0 N--CA 1.48 1.067 0 O-C-N 124.044 0.84 . . . . 0.0 110.895 -177.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -58.86 -57.75 11.68 Favored 'General case' 0 C--N 1.36 1.035 0 O-C-N 123.614 0.571 . . . . 0.0 111.359 175.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.618 ' HB2' ' HA ' ' A' ' 58' ' ' LEU . 2.2 pp -84.04 -25.32 29.96 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -174.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.49 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 3.5 m-70 . . . . . 0 N--CA 1.493 1.715 0 C-N-CA 123.845 0.858 . . . . 0.0 109.571 177.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.618 ' HA ' ' HB2' ' A' ' 27' ' ' LEU . 9.2 mt . . . . . 0 CA--C 1.539 0.54 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -81.08 142.76 23.5 Favored Glycine 0 C--N 1.349 1.273 0 CA-C-O 119.292 -0.727 . . . . 0.0 112.039 177.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -55.41 -54.74 39.94 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 124.365 1.066 . . . . 0.0 112.014 -174.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.4 p -53.29 -41.24 42.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 123.701 0.8 . . . . 0.0 111.492 178.111 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.426 ' HA3' HD23 ' A' ' 27' ' ' LEU . . . -67.89 -41.64 87.68 Favored Glycine 0 C--O 1.215 -1.053 0 O-C-N 123.767 0.667 . . . . 0.0 113.049 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -66.75 -46.34 75.7 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.205 0.602 . . . . 0.0 111.01 -178.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -63.27 -37.3 86.69 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.837 0.855 . . . . 0.0 110.884 178.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -71.27 -45.03 64.1 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.141 -179.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.7 mp -62.27 -33.23 74.22 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.562 1.145 . . . . 0.0 110.932 176.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 73.3 ttt180 -67.95 -43.35 79.28 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.672 0.789 . . . . 0.0 110.339 176.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -67.62 -38.36 83.8 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.755 0.822 . . . . 0.0 111.273 179.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.65 HG21 ' HB3' ' A' ' 20' ' ' GLN . 96.6 mt -69.61 -41.67 80.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.858 0.863 . . . . 0.0 110.075 177.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -63.73 -38.56 91.55 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.673 0.789 . . . . 0.0 110.76 178.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.499 ' HB1' HH12 ' A' ' 75' ' ' ARG . . . -63.95 -42.91 97.17 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.867 0.867 . . . . 0.0 110.687 177.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.446 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -66.0 -51.32 59.41 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 114.913 -1.039 . . . . 0.0 111.102 179.1 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.522 HD23 HD12 ' A' ' 76' ' ' ILE . 82.1 mt -62.59 -36.72 83.61 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.427 1.091 . . . . 0.0 111.886 -179.214 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.81 -43.9 97.59 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.469 0.708 . . . . 0.0 110.244 175.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.499 HH12 ' HB1' ' A' ' 71' ' ' ALA . 80.7 mtt85 -73.51 -26.3 60.82 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 115.244 -0.889 . . . . 0.0 112.267 179.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.522 HD12 HD23 ' A' ' 73' ' ' LEU . 80.6 mt -69.76 -46.59 74.05 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 CA-C-N 118.473 0.579 . . . . 0.0 109.536 174.615 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.74 -36.59 83.52 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.867 178.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 30.2 t -81.09 -17.77 48.86 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 123.729 0.812 . . . . 0.0 111.433 177.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 81.6 10.3 84.55 Favored Glycine 0 C--N 1.35 1.35 0 C-N-CA 123.198 0.428 . . . . 0.0 113.893 178.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.8 t -106.89 21.33 17.7 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 124.415 1.086 . . . . 0.0 110.261 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -61.46 142.79 56.76 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 122.578 0.351 . . . . 0.0 110.335 173.065 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.516 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 82.5 20.72 61.49 Favored Glycine 0 C--O 1.218 -0.864 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.521 -175.234 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 26.4 m -113.11 110.43 20.43 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 117.524 0.662 . . . . 0.0 109.825 174.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . 0.446 ' HB2' HD13 ' A' ' 91' ' ' ILE . 49.2 t -73.45 93.91 2.03 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 124.459 1.104 . . . . 0.0 109.857 172.239 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 34.1 m -63.85 -22.25 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.298 1.039 . . . . 0.0 112.751 -176.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.534 ' HD3' ' HB3' ' A' ' 108' ' ' CYS . 56.4 tttm -69.83 -24.44 63.46 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 122.675 0.39 . . . . 0.0 111.585 -178.288 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 29.0 p -127.59 11.16 6.74 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 122.626 0.37 . . . . 0.0 110.879 173.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 56.63 27.11 54.38 Favored Glycine 0 C--N 1.36 1.9 0 C-N-CA 123.869 0.747 . . . . 0.0 114.932 176.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -135.96 -176.7 4.39 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.983 0.913 . . . . 0.0 110.228 -174.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.516 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 12.8 tpp180 -68.77 152.29 45.52 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 124.585 1.154 . . . . 0.0 112.664 -172.041 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.446 HD13 ' HB2' ' A' ' 84' ' ' CYS . 3.1 mm -92.16 145.36 7.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 165.302 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 61.8 m -66.99 145.25 55.6 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 122.252 0.221 . . . . 0.0 110.561 176.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -61.47 -39.94 92.72 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.254 0.622 . . . . 0.0 110.42 177.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.436 ' HA ' ' HG2' ' A' ' 97' ' ' LYS . 16.1 m-20 -65.2 -35.69 81.84 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.863 0.865 . . . . 0.0 111.303 178.266 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -63.87 -44.12 94.03 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.07 176.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 96.3 mt -75.45 -36.49 60.7 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.364 0.666 . . . . 0.0 112.502 -176.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.436 ' HG2' ' HA ' ' A' ' 94' ' ' ASP . 16.6 ptpt -73.25 -28.81 62.35 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 120.528 0.204 . . . . 0.0 110.713 -176.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -80.48 -48.66 12.49 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 123.923 0.765 . . . . 0.0 110.299 174.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.1 p -144.72 99.96 4.72 Favored Pre-proline 0 CA--C 1.555 1.161 0 C-N-CA 124.231 1.012 . . . . 0.0 109.299 -178.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -78.47 -5.57 14.97 Favored 'Trans proline' 0 C--N 1.373 1.836 0 C-N-CA 122.531 2.154 . . . . 0.0 113.021 178.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 18.9 p90 -105.34 54.37 0.7 Allowed 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.718 0.807 . . . . 0.0 110.032 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.8 t -135.14 101.57 11.24 Favored Pre-proline 0 CA--C 1.554 1.099 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.639 172.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -59.8 -18.79 50.91 Favored 'Trans proline' 0 C--N 1.382 2.295 0 C-N-CA 123.245 2.63 . . . . 0.0 113.096 172.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -104.48 126.09 51.25 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.841 0.857 . . . . 0.0 109.859 -177.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 16.5 p -69.39 158.88 34.25 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 171.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 62.9 tp60 -48.13 -39.84 21.78 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 114.09 1.144 . . . . 0.0 114.09 -169.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -69.37 -34.0 73.92 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-N 117.943 0.338 . . . . 0.0 111.849 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.534 ' HB3' ' HD3' ' A' ' 86' ' ' LYS . 99.5 m -72.33 -38.85 68.55 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.331 0.652 . . . . 0.0 111.396 174.19 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.58 -33.25 75.47 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.826 0.85 . . . . 0.0 111.017 176.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.99 -31.38 58.95 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.016 0.926 . . . . 0.0 111.047 176.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.848 0 C-N-CA 123.726 0.81 . . . . 0.0 112.276 -178.335 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.0 m120 . . . . . 0 N--CA 1.487 1.41 0 N-CA-C 111.817 0.303 . . . . 0.0 111.817 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 86.2 t -50.98 -41.21 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.607 1.163 . . . . 0.0 112.106 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -64.21 -37.4 87.35 Favored 'General case' 0 N--CA 1.484 1.27 0 O-C-N 123.722 0.639 . . . . 0.0 111.499 -176.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 17.4 m -63.0 -42.5 99.86 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.556 0.742 . . . . 0.0 110.042 176.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.522 ' HA ' HG22 ' A' ' 15' ' ' ILE . 28.3 m-85 -72.25 -33.79 67.77 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-N 114.611 -1.177 . . . . 0.0 110.735 179.131 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -59.73 -52.53 65.11 Favored 'General case' 0 C--O 1.246 0.875 0 C-N-CA 125.082 1.353 . . . . 0.0 110.268 -175.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.05 -48.49 68.14 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.995 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.522 HG22 ' HA ' ' A' ' 12' ' ' TYR . 13.3 tt -64.66 -29.65 48.0 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.35 0 CA-C-N 118.197 0.453 . . . . 0.0 110.688 -173.031 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.511 ' HB3' HG23 ' A' ' 69' ' ' ILE . 45.5 mt -62.34 -50.53 71.23 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.205 0.602 . . . . 0.0 110.248 172.27 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 52.3 mtm180 -64.23 -28.52 69.79 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.488 -0.778 . . . . 0.0 112.441 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -80.98 -33.34 33.85 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.302 0.641 . . . . 0.0 110.351 -177.302 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.449 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -69.46 -42.6 74.67 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.021 172.698 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.656 ' HB3' HG21 ' A' ' 69' ' ' ILE . 1.4 pt20 -71.37 -22.59 61.87 Favored 'General case' 0 C--O 1.208 -1.083 0 CA-C-O 119.349 -0.358 . . . . 0.0 110.324 179.554 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 32.6 mtt180 -62.84 -60.01 4.07 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.188 0.595 . . . . 0.0 110.52 173.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -60.98 -34.22 74.44 Favored 'General case' 0 N--CA 1.48 1.051 0 O-C-N 123.933 0.771 . . . . 0.0 110.833 -178.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 86.5 mt -69.08 -51.87 34.22 Favored 'General case' 0 C--N 1.352 0.707 0 C-N-CA 122.984 0.514 . . . . 0.0 111.336 176.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -56.19 -39.6 72.66 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 123.552 0.741 . . . . 0.0 111.416 -173.017 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 18.1 ptt180 -78.02 -33.36 51.16 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 122.428 0.291 . . . . 0.0 111.2 178.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 25.2 ttm180 -65.1 -41.42 94.95 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.517 0.727 . . . . 0.0 111.361 177.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.465 HD21 HD22 ' A' ' 66' ' ' LEU . 4.3 pp -94.02 -28.58 15.68 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.799 0.44 . . . . 0.0 111.193 -172.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 167.591 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.409 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 7.8 mt . . . . . 0 CA--C 1.547 0.847 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -64.65 145.01 49.11 Favored Glycine 0 N--CA 1.477 1.387 0 CA-C-O 119.592 -0.56 . . . . 0.0 113.27 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -64.07 -60.35 3.34 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.699 0.8 . . . . 0.0 111.719 -174.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.2 t -58.89 -32.34 47.03 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 123.881 0.872 . . . . 0.0 110.2 177.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.514 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -59.66 -51.77 57.02 Favored Glycine 0 C--N 1.353 1.511 0 O-C-N 124.051 0.844 . . . . 0.0 112.624 174.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -72.27 -36.66 69.07 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 124.098 0.959 . . . . 0.0 112.339 -175.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -73.28 -38.77 65.79 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.413 0.685 . . . . 0.0 110.369 -176.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -71.22 -37.05 72.05 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.627 174.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' A' ' 62' ' ' GLY . 6.2 tp -58.62 -45.95 88.13 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 124.606 1.162 . . . . 0.0 109.568 177.209 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 47.4 ttt180 -64.84 -38.84 92.31 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.481 1.112 . . . . 0.0 110.5 -178.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.52 -36.64 83.2 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.914 177.015 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.656 HG21 ' HB3' ' A' ' 20' ' ' GLN . 95.0 mt -69.86 -49.79 54.24 Favored 'Isoleucine or valine' 0 C--N 1.356 0.86 0 C-N-CA 123.594 0.758 . . . . 0.0 110.83 178.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 52.6 m-20 -65.18 -35.64 81.71 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.753 0.821 . . . . 0.0 111.151 -177.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.432 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -64.88 -45.5 85.73 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.312 0.645 . . . . 0.0 109.96 175.028 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.412 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -67.15 -34.91 78.58 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.993 0.917 . . . . 0.0 111.709 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.47 HD23 HD12 ' A' ' 76' ' ' ILE . 71.9 mt -72.75 -32.33 65.59 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.857 0.863 . . . . 0.0 110.821 177.099 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.57 -27.64 63.29 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.875 0.87 . . . . 0.0 110.785 174.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.432 ' HG2' ' O ' ' A' ' 71' ' ' ALA . 5.7 mmp_? -69.06 -42.48 76.2 Favored 'General case' 0 C--N 1.353 0.75 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 172.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.47 HD12 HD23 ' A' ' 73' ' ' LEU . 71.1 mt -64.68 -41.36 92.0 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 C-N-CA 123.206 0.602 . . . . 0.0 110.367 177.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -59.37 -38.81 81.39 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.027 0.931 . . . . 0.0 111.292 178.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.535 ' HB3' HG22 ' A' ' 80' ' ' THR . 35.5 t -87.05 -13.9 43.04 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 115.027 -0.988 . . . . 0.0 111.226 178.279 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 78.75 8.15 87.88 Favored Glycine 0 C--N 1.348 1.25 0 C-N-CA 123.177 0.417 . . . . 0.0 113.441 -176.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.535 HG22 ' HB3' ' A' ' 78' ' ' SER . 13.5 t -101.4 24.58 9.41 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.708 1.203 . . . . 0.0 110.065 -178.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -61.89 152.87 30.66 Favored 'General case' 0 C--N 1.35 0.595 0 C-N-CA 123.222 0.609 . . . . 0.0 110.351 170.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.53 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 70.39 21.39 77.42 Favored Glycine 0 C--N 1.344 0.984 0 CA-C-N 115.639 -0.71 . . . . 0.0 112.476 -176.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 30.9 m -118.23 113.89 22.19 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.471 0.709 . . . . 0.0 109.69 178.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 52.7 t -72.93 90.12 1.45 Allowed 'General case' 0 C--O 1.238 0.472 0 C-N-CA 123.438 0.695 . . . . 0.0 109.517 171.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 29.5 m -61.22 -23.03 28.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 124.411 1.084 . . . . 0.0 112.756 -176.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.401 ' HD3' ' HB3' ' A' ' 108' ' ' CYS . 54.5 tttm -64.71 -27.2 68.75 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.305 0.642 . . . . 0.0 111.588 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.442 ' SG ' ' HB2' ' A' ' 89' ' ' LYS . 30.7 p -136.14 4.12 2.94 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 112.038 0.384 . . . . 0.0 112.038 -179.252 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 63.06 30.89 78.87 Favored Glycine 0 C--N 1.349 1.264 0 O-C-N 123.128 0.267 . . . . 0.0 113.723 -178.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.442 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 11.5 mmmm -106.88 172.08 7.01 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.806 0.842 . . . . 0.0 110.462 -179.568 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.53 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 15.2 tpp180 -90.92 128.4 36.76 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.126 0.97 . . . . 0.0 109.651 177.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 9.2 mm -64.91 142.4 16.97 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 171.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 19.6 m -74.26 150.72 40.11 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 122.847 0.459 . . . . 0.0 109.774 177.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -61.96 -37.14 83.64 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 122.919 0.488 . . . . 0.0 110.287 175.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -62.17 -45.87 91.46 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 124.115 0.966 . . . . 0.0 110.755 176.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.442 ' HG3' HG21 ' A' ' 102' ' ' THR . 28.3 tpt180 -60.85 -40.62 93.57 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.405 175.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 82.0 mt -69.75 -38.45 76.81 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.508 0.723 . . . . 0.0 112.184 -178.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -79.18 -30.95 43.69 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 122.372 0.269 . . . . 0.0 110.42 -174.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -80.06 -39.28 30.08 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.806 0.842 . . . . 0.0 110.641 177.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.5 p -148.48 92.3 4.54 Favored Pre-proline 0 CA--C 1.556 1.196 0 C-N-CA 124.33 1.052 . . . . 0.0 109.49 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.06 -17.3 31.82 Favored 'Trans proline' 0 C--N 1.378 2.086 0 C-N-CA 122.404 2.069 . . . . 0.0 112.346 175.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 10.7 p90 -94.6 62.71 2.82 Favored 'General case' 0 C--N 1.348 0.525 0 C-N-CA 124.333 1.053 . . . . 0.0 109.092 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.442 HG21 ' HG3' ' A' ' 95' ' ' ARG . 12.4 t -137.54 117.08 10.19 Favored Pre-proline 0 CA--C 1.553 1.089 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.511 178.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -81.23 -7.29 12.98 Favored 'Trans proline' 0 C--N 1.368 1.568 0 C-N-CA 122.259 1.972 . . . . 0.0 111.877 169.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -116.97 143.97 45.11 Favored 'General case' 0 C--N 1.356 0.858 0 C-N-CA 123.465 0.706 . . . . 0.0 110.162 -175.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 30.6 p -80.89 164.25 22.77 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 174.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -51.31 -37.77 49.34 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.791 0.837 . . . . 0.0 111.705 -178.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -54.88 -53.59 53.48 Favored 'General case' 0 CA--C 1.55 0.957 0 O-C-N 124.378 1.049 . . . . 0.0 110.74 175.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.401 ' HB3' ' HD3' ' A' ' 86' ' ' LYS . 87.8 m -71.35 -34.24 70.33 Favored 'General case' 0 N--CA 1.482 1.141 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.68 -176.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -63.28 -38.85 92.75 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.718 0.807 . . . . 0.0 110.546 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -77.34 -25.94 51.57 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.802 0.841 . . . . 0.0 111.108 176.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.551 1.012 0 C-N-CA 123.898 0.879 . . . . 0.0 111.976 -176.768 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 . . . . . 0 N--CA 1.475 0.82 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 90.6 t -54.92 -41.81 60.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 CA-C-N 114.675 -1.148 . . . . 0.0 111.966 -172.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -61.07 -39.22 89.07 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.708 0.803 . . . . 0.0 111.732 -177.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 17.7 m -62.5 -42.2 99.34 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.379 0.672 . . . . 0.0 110.013 177.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.475 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 26.4 m-85 -71.6 -33.02 68.64 Favored 'General case' 0 C--O 1.213 -0.844 0 CA-C-N 114.558 -1.201 . . . . 0.0 110.788 179.066 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -67.42 -53.13 31.75 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 124.047 0.939 . . . . 0.0 110.523 -175.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -63.13 -43.32 98.69 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.416 -179.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.495 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 13.7 tt -65.24 -33.4 63.42 Favored 'Isoleucine or valine' 0 C--N 1.363 1.16 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 -177.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.531 ' HB3' HG23 ' A' ' 69' ' ' ILE . 61.2 mt -67.17 -36.82 82.61 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.127 0.571 . . . . 0.0 111.402 177.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 19.8 mtm180 -63.79 -41.49 97.92 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 123.279 0.362 . . . . 0.0 110.856 176.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -69.78 -40.25 76.15 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.028 0.531 . . . . 0.0 111.468 -179.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.495 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -63.99 -50.34 68.92 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.442 0.697 . . . . 0.0 110.276 178.621 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.614 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.9 pt20 -64.71 -31.56 72.83 Favored 'General case' 0 C--O 1.213 -0.864 0 CA-C-O 119.248 -0.406 . . . . 0.0 110.494 -178.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 29.6 mtt85 -68.68 -51.03 46.2 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.43 0.692 . . . . 0.0 112.129 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -61.37 -35.1 76.53 Favored 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 178.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.535 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 95.6 mt -67.0 -45.47 77.51 Favored 'General case' 0 C--O 1.215 -0.75 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.674 173.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -60.62 -47.24 87.1 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.883 0.873 . . . . 0.0 111.954 -173.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 9.0 ptp180 -66.72 -35.43 80.11 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 122.637 0.375 . . . . 0.0 110.273 176.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -63.5 -43.63 96.69 Favored 'General case' 0 C--N 1.362 1.11 0 C-N-CA 123.709 0.804 . . . . 0.0 112.031 178.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 2.7 pp -86.09 -21.23 27.76 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 122.977 0.511 . . . . 0.0 111.319 -176.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 57.6 m-70 . . . . . 0 N--CA 1.484 1.25 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 171.189 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.487 HD13 HD13 ' A' ' 27' ' ' LEU . 19.1 mt . . . . . 0 CA--C 1.54 0.594 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 119.82 146.1 7.66 Favored Glycine 0 N--CA 1.475 1.278 0 CA-C-O 119.253 -0.749 . . . . 0.0 111.651 177.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 60.3 tt0 -58.08 -50.9 71.84 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.047 0.939 . . . . 0.0 111.892 -173.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 7.1 p -54.74 -38.79 44.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 123.71 0.804 . . . . 0.0 111.402 179.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -71.3 -53.5 10.3 Favored Glycine 0 C--N 1.346 1.124 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.797 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -65.46 -38.11 88.86 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 124.249 1.02 . . . . 0.0 111.534 -175.065 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -69.13 -43.29 74.68 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.889 0.876 . . . . 0.0 110.252 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -70.41 -35.64 73.55 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.577 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.3 mp -63.15 -39.59 95.1 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.215 1.006 . . . . 0.0 110.792 175.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 52.6 ttt180 -59.89 -45.7 91.7 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.932 0.893 . . . . 0.0 110.026 175.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.519 ' HB1' ' O ' ' A' ' 101' ' ' TYR . . . -64.87 -44.79 88.53 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 114.713 -1.131 . . . . 0.0 111.922 -178.272 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.614 HG21 ' HB3' ' A' ' 20' ' ' GLN . 83.3 mt -70.74 -44.64 76.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 123.581 0.752 . . . . 0.0 110.81 -178.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -68.2 -37.48 80.95 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.365 0.666 . . . . 0.0 110.835 -175.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.464 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -64.93 -43.08 93.95 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.795 0.684 . . . . 0.0 110.232 176.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.43 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -62.09 -45.5 93.22 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 123.884 0.74 . . . . 0.0 110.996 177.649 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.541 HD23 HD12 ' A' ' 76' ' ' ILE . 86.2 mt -63.31 -34.92 78.73 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 124.263 1.025 . . . . 0.0 111.589 176.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.44 -35.92 81.51 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.464 0.706 . . . . 0.0 110.711 177.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.464 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 52.6 mtp85 -72.77 -29.09 63.01 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.987 176.511 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.541 HD12 HD23 ' A' ' 73' ' ' LEU . 84.0 mt -66.99 -44.08 88.68 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 122.574 0.35 . . . . 0.0 110.084 176.252 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.1 -35.23 80.48 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.521 0.729 . . . . 0.0 111.119 177.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.417 ' HB3' HG22 ' A' ' 80' ' ' THR . 32.4 t -79.64 -19.8 48.28 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 123.604 0.762 . . . . 0.0 111.358 177.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 80.58 12.1 83.31 Favored Glycine 0 C--N 1.351 1.365 0 C-N-CA 123.034 0.349 . . . . 0.0 113.6 -178.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.417 HG22 ' HB3' ' A' ' 78' ' ' SER . 10.2 t -110.28 21.54 16.59 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 124.279 1.032 . . . . 0.0 110.781 179.558 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 75.6 t80 -60.14 145.26 47.51 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.118 0.567 . . . . 0.0 111.595 171.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 75.11 38.53 39.83 Favored Glycine 0 C--N 1.348 1.247 0 O-C-N 124.016 0.823 . . . . 0.0 111.926 -176.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 40.5 m -127.78 117.9 22.73 Favored 'General case' 0 C--O 1.243 0.731 0 C-N-CA 124.014 0.926 . . . . 0.0 109.16 175.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 51.2 t -61.49 102.7 0.26 Allowed 'General case' 0 C--N 1.351 0.649 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 169.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 23.1 m -56.69 -38.42 57.73 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 C-N-CA 124.312 1.045 . . . . 0.0 111.562 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -68.77 -21.65 64.34 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.07 0.948 . . . . 0.0 111.361 -177.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 59.9 m -105.24 -29.65 10.18 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.398 0.679 . . . . 0.0 111.962 178.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 66.34 32.08 80.89 Favored Glycine 0 CA--C 1.536 1.35 0 N-CA-C 111.624 -0.59 . . . . 0.0 111.624 -161.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -130.73 -178.44 4.8 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.971 0.909 . . . . 0.0 110.999 -174.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 25.8 mmm180 -71.99 159.95 33.35 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.832 0.853 . . . . 0.0 113.17 -175.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 39.2 mm -106.93 147.0 12.62 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 CA-C-N 114.521 -1.218 . . . . 0.0 108.196 163.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 13.2 m -73.97 149.78 41.14 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.418 0.687 . . . . 0.0 110.252 178.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -58.8 -45.16 90.56 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.48 0.712 . . . . 0.0 110.23 175.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.403 ' HA ' ' HE3' ' A' ' 97' ' ' LYS . 38.0 m-20 -65.32 -31.87 73.23 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.457 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.535 ' HA ' ' HE ' ' A' ' 95' ' ' ARG . 2.1 tpm_? -70.79 -40.75 72.37 Favored 'General case' 0 C--O 1.216 -0.687 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.095 175.278 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 79.5 mt -70.63 -39.53 73.63 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.377 0.671 . . . . 0.0 111.723 -178.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.403 ' HE3' ' HA ' ' A' ' 94' ' ' ASP . 16.0 ptpt -71.81 -31.88 67.01 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 122.684 0.394 . . . . 0.0 110.312 -176.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -77.17 -58.24 3.39 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.073 0.549 . . . . 0.0 110.386 174.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.6 p -130.98 95.2 26.06 Favored Pre-proline 0 CA--C 1.562 1.427 0 C-N-CA 124.81 1.244 . . . . 0.0 109.857 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -80.14 -11.66 13.37 Favored 'Trans proline' 0 C--N 1.378 2.106 0 C-N-CA 122.71 2.273 . . . . 0.0 112.929 177.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . 0.519 ' O ' ' HB1' ' A' ' 68' ' ' ALA . 10.2 p90 -95.74 36.29 1.3 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.329 0.651 . . . . 0.0 111.069 179.678 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 15.0 t -106.78 120.26 48.79 Favored Pre-proline 0 CA--C 1.555 1.159 0 O-C-N 122.088 -0.382 . . . . 0.0 110.506 177.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -78.41 -9.37 16.22 Favored 'Trans proline' 0 C--N 1.376 2.013 0 C-N-CA 122.361 2.04 . . . . 0.0 112.097 168.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.437 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 14.9 m-85 -118.13 159.04 23.96 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.043 0.537 . . . . 0.0 110.465 -174.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 31.1 p -85.81 169.5 13.3 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 174.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.495 ' HB2' ' HD2' ' A' ' 95' ' ' ARG . 36.1 tt0 -59.32 -28.39 66.77 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 122.985 0.514 . . . . 0.0 111.439 -176.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -70.04 -47.17 63.14 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.319 1.048 . . . . 0.0 109.851 -178.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.437 ' HB2' ' HB3' ' A' ' 104' ' ' PHE . 94.0 m -68.44 -36.08 78.52 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.1 175.37 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -62.8 -36.58 83.61 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.161 0.985 . . . . 0.0 111.058 178.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.29 -33.74 70.01 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.575 174.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.548 0.896 0 C-N-CA 123.67 0.788 . . . . 0.0 112.84 -179.677 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 N--CA 1.477 0.902 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 22.8 t -63.33 -37.68 80.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.959 -173.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -58.47 -41.16 84.62 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 124.192 0.933 . . . . 0.0 110.845 -178.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.3 m -58.54 -47.24 84.87 Favored 'General case' 0 C--N 1.351 0.654 0 O-C-N 124.097 0.873 . . . . 0.0 110.611 176.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.413 ' HA ' HG22 ' A' ' 15' ' ' ILE . 51.8 m-85 -67.87 -37.72 82.16 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 124.335 1.022 . . . . 0.0 111.361 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.456 ' O ' ' HG3' ' A' ' 17' ' ' ARG . 2.4 tm-20 -60.97 -56.49 20.45 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.29 1.036 . . . . 0.0 110.145 -176.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -72.13 -35.65 69.18 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.048 -175.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.445 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 11.4 tt -66.72 -33.9 66.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 CA-C-N 118.368 0.531 . . . . 0.0 110.128 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.481 ' HB3' HG23 ' A' ' 69' ' ' ILE . 64.0 mt -67.48 -38.32 84.2 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 122.964 0.506 . . . . 0.0 110.557 174.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.5 ' O ' ' HG2' ' A' ' 21' ' ' ARG . 15.5 mtm180 -64.79 -46.05 83.67 Favored 'General case' 0 C--N 1.353 0.732 0 O-C-N 123.314 0.384 . . . . 0.0 110.29 176.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.78 -46.76 88.15 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.527 0.731 . . . . 0.0 111.058 -177.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.445 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -65.74 -41.11 92.55 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.637 178.933 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.708 ' HB3' HG21 ' A' ' 69' ' ' ILE . 1.4 pt20 -67.12 -36.86 82.81 Favored 'General case' 0 C--O 1.206 -1.207 0 CA-C-O 118.937 -0.554 . . . . 0.0 110.091 -179.444 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.5 ' HG2' ' O ' ' A' ' 17' ' ' ARG . 4.2 mmp_? -61.12 -50.37 73.49 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 118.18 0.445 . . . . 0.0 110.899 -178.056 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -64.64 -33.37 75.77 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 123.511 0.507 . . . . 0.0 111.461 177.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.549 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 77.6 mt -77.35 -31.89 54.73 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 122.967 0.507 . . . . 0.0 112.105 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.439 ' HD1' ' O ' ' A' ' 20' ' ' GLN . 3.6 m-85 -65.51 -48.58 72.04 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -179.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 20.6 ptt180 -73.02 -26.11 61.2 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.137 178.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 38.4 ttm-85 -59.1 -56.86 16.73 Favored 'General case' 0 C--N 1.36 1.059 0 C-N-CA 123.234 0.614 . . . . 0.0 110.513 173.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 2.4 pp -82.05 -24.63 35.2 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -173.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 . . . . . 0 N--CA 1.486 1.359 0 C-N-CA 123.243 0.617 . . . . 0.0 109.892 171.985 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.505 HD22 HD13 ' A' ' 27' ' ' LEU . 79.1 mt . . . . . 0 CA--C 1.54 0.587 0 N-CA-C 111.857 0.318 . . . . 0.0 111.857 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 119.61 124.84 3.28 Favored Glycine 0 N--CA 1.472 1.096 0 N-CA-C 110.641 -0.984 . . . . 0.0 110.641 -175.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -58.65 -49.71 76.52 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 124.389 1.076 . . . . 0.0 112.734 -167.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.433 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 8.4 p -57.1 -42.74 80.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 O-C-N 124.004 0.815 . . . . 0.0 111.545 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.41 -38.63 70.07 Favored Glycine 0 C--N 1.348 1.199 0 O-C-N 123.82 0.7 . . . . 0.0 112.822 -177.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -63.75 -48.47 76.85 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.615 0.766 . . . . 0.0 111.488 -178.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -72.14 -23.57 61.32 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.869 179.415 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 61' ' ' VAL . 12.8 tt0 -74.97 -39.26 61.39 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 176.302 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.441 HD22 HD21 ' A' ' 27' ' ' LEU . 7.2 mp -63.67 -43.14 97.57 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.841 0.856 . . . . 0.0 110.153 173.171 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -60.5 -39.68 88.6 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 123.68 0.612 . . . . 0.0 109.881 179.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.12 -38.57 75.61 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.901 0.88 . . . . 0.0 111.636 178.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.708 HG21 ' HB3' ' A' ' 20' ' ' GLN . 78.5 mt -69.88 -57.61 7.76 Favored 'Isoleucine or valine' 0 C--N 1.363 1.153 0 C-N-CA 123.172 0.589 . . . . 0.0 110.765 -179.216 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -62.71 -28.95 70.3 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.368 1.067 . . . . 0.0 111.739 -178.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.445 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -69.05 -44.16 73.2 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 122.705 0.402 . . . . 0.0 110.037 172.206 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -66.11 -32.32 73.71 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.817 0.847 . . . . 0.0 111.274 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 90.4 mt -70.7 -37.31 73.57 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.963 0.905 . . . . 0.0 110.254 174.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.57 -26.91 65.64 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.758 0.823 . . . . 0.0 111.229 174.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.445 ' HG2' ' O ' ' A' ' 71' ' ' ALA . 5.7 mmp_? -70.32 -40.2 74.32 Favored 'General case' 0 C--N 1.357 0.908 0 C-N-CA 122.997 0.519 . . . . 0.0 109.799 173.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 81.8 mt -66.12 -43.42 92.21 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.243 0 C-N-CA 123.397 0.679 . . . . 0.0 110.292 178.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.29 -39.88 94.41 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.261 1.025 . . . . 0.0 110.775 178.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.427 ' HB3' HG22 ' A' ' 80' ' ' THR . 47.1 t -77.13 -24.73 51.62 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.677 0.791 . . . . 0.0 111.299 177.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 86.82 13.42 66.95 Favored Glycine 0 C--N 1.347 1.177 0 C-N-CA 123.169 0.414 . . . . 0.0 113.045 -176.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.427 HG22 ' HB3' ' A' ' 78' ' ' SER . 14.8 t -110.84 24.38 13.01 Favored 'General case' 0 CA--C 1.557 1.215 0 C-N-CA 124.329 1.051 . . . . 0.0 110.825 -179.087 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -70.95 142.92 51.03 Favored 'General case' 0 N--CA 1.477 0.913 0 O-C-N 121.977 -0.452 . . . . 0.0 109.95 168.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 77.29 26.97 60.56 Favored Glycine 0 C--N 1.346 1.098 0 O-C-N 123.903 0.752 . . . . 0.0 111.741 -173.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 49.3 m -122.77 119.71 31.42 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 124.142 0.977 . . . . 0.0 110.028 177.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . 0.765 ' SG ' ' SG ' ' A' ' 105' ' ' CYS . 29.5 t -63.07 94.06 0.07 Allowed 'General case' 0 C--N 1.349 0.572 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 166.581 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 34.8 m -64.98 -25.73 38.4 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 C-N-CA 124.146 0.978 . . . . 0.0 111.248 -174.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.574 ' HD3' ' HB3' ' A' ' 108' ' ' CYS . 57.7 tttm -73.94 -14.64 61.08 Favored 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 124.723 1.209 . . . . 0.0 112.159 -177.342 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.671 ' SG ' ' SG ' ' A' ' 84' ' ' CYS . 4.3 m -132.31 -21.0 2.35 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -175.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 69.95 52.62 18.3 Favored Glycine 0 C--N 1.347 1.173 0 O-C-N 123.228 0.33 . . . . 0.0 112.623 -169.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.529 ' HG2' ' HB2' ' A' ' 87' ' ' CYS . 19.5 ptpt -143.88 -167.97 2.73 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.547 0.739 . . . . 0.0 109.558 176.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.3 mmm180 -76.65 160.85 29.03 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.962 0.905 . . . . 0.0 113.411 -178.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 19.1 mm -104.57 144.18 14.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 114.342 -1.299 . . . . 0.0 107.542 159.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.8 p -73.93 152.97 40.0 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.589 0.756 . . . . 0.0 110.767 176.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -68.45 -36.95 79.75 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.064 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -59.35 -40.4 86.26 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.031 0.933 . . . . 0.0 111.159 175.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 29.4 tpt180 -64.06 -45.32 89.31 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.143 175.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 95.7 mt -71.02 -32.92 69.83 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.407 0.683 . . . . 0.0 112.763 -175.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.3 ptpt -81.75 -27.43 33.82 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.489 0.315 . . . . 0.0 110.433 -177.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -78.43 -43.82 26.3 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.588 0.755 . . . . 0.0 110.493 174.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.7 p -152.86 95.38 3.03 Favored Pre-proline 0 CA--C 1.557 1.23 0 C-N-CA 124.478 1.111 . . . . 0.0 109.2 -176.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -74.44 -9.82 21.8 Favored 'Trans proline' 0 C--N 1.376 2.014 0 C-N-CA 122.615 2.21 . . . . 0.0 112.487 175.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 11.1 p90 -102.92 67.01 0.94 Allowed 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.206 1.002 . . . . 0.0 108.965 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 10.4 t -140.92 117.91 7.74 Favored Pre-proline 0 CA--C 1.551 0.983 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.575 177.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.23 -24.34 23.33 Favored 'Trans proline' 0 C--N 1.373 1.838 0 C-N-CA 122.262 1.975 . . . . 0.0 111.8 173.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -105.54 144.82 31.77 Favored 'General case' 0 C--N 1.352 0.713 0 CA-C-O 122.305 1.05 . . . . 0.0 111.133 -176.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.829 ' SG ' ' HB2' ' A' ' 108' ' ' CYS . 3.5 p -64.3 164.97 10.25 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 113.628 -1.624 . . . . 0.0 110.556 167.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.2 tt0 -55.34 -51.82 65.5 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 123.895 0.878 . . . . 0.0 112.367 -174.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.56 -29.82 52.34 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -174.569 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.829 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 75.7 m -78.34 -25.61 46.48 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.358 0.263 . . . . 0.0 111.366 177.072 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.05 -35.45 69.33 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 123.705 0.628 . . . . 0.0 109.878 169.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.38 -29.09 63.44 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.82 0.848 . . . . 0.0 112.054 178.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.907 0 C-N-CA 123.689 0.796 . . . . 0.0 111.462 -174.455 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 55.4 t30 . . . . . 0 C--O 1.246 0.906 0 CA-C-O 122.154 0.978 . . . . 0.0 110.121 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 81.7 t -65.5 -32.44 58.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 CA-C-N 114.238 -1.346 . . . . 0.0 111.135 -177.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -59.58 -36.34 76.05 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.191 0.996 . . . . 0.0 112.599 -176.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 71.9 m -69.88 -39.21 76.43 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 122.715 0.406 . . . . 0.0 111.064 176.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -68.99 -34.27 75.03 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.098 0.559 . . . . 0.0 110.043 175.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -63.22 -56.23 18.38 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.749 1.22 . . . . 0.0 109.259 -177.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.445 ' NZ ' ' HB2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -67.61 -39.84 84.71 Favored 'General case' 0 C--O 1.219 -0.545 0 CA-C-N 115.696 -0.683 . . . . 0.0 112.164 -175.057 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 13.5 tt -64.98 -31.77 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 CA-C-O 120.965 0.412 . . . . 0.0 110.242 -177.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.58 ' HB3' HG23 ' A' ' 69' ' ' ILE . 64.4 mt -69.63 -42.0 74.89 Favored 'General case' 0 C--N 1.349 0.556 0 C-N-CA 123.368 0.667 . . . . 0.0 110.847 174.084 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.5 ' O ' ' HG2' ' A' ' 21' ' ' ARG . 1.8 mmp_? -61.67 -46.35 90.1 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 123.388 0.675 . . . . 0.0 110.361 177.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -59.11 -47.34 85.61 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.583 0.753 . . . . 0.0 110.551 178.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -66.43 -41.27 89.44 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 114.806 -1.088 . . . . 0.0 111.544 -176.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.678 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.8 pt20 -71.68 -32.99 68.44 Favored 'General case' 0 C--O 1.212 -0.918 0 CA-C-O 118.525 -0.75 . . . . 0.0 110.673 -177.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.5 ' HG2' ' O ' ' A' ' 17' ' ' ARG . 22.9 mmt180 -67.6 -46.81 71.5 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.192 0.597 . . . . 0.0 110.826 -177.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -66.54 -32.88 74.5 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.871 178.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.532 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 89.4 mt -77.58 -32.24 53.57 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-O 118.631 -0.7 . . . . 0.0 111.842 176.364 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -58.54 -54.46 46.75 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 123.239 0.616 . . . . 0.0 109.507 178.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.5 ptt180 -72.83 -25.84 61.27 Favored 'General case' 0 CA--C 1.549 0.913 0 CA-C-N 114.832 -1.076 . . . . 0.0 111.522 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 52.3 ttm-85 -63.15 -52.08 63.89 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.022 0.529 . . . . 0.0 112.102 175.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.63 HD21 HD22 ' A' ' 66' ' ' LEU . 2.9 pp -81.44 -25.67 35.94 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 122.334 -0.229 . . . . 0.0 111.02 -178.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 6.1 m170 . . . . . 0 N--CA 1.486 1.366 0 C-N-CA 122.952 0.501 . . . . 0.0 110.594 169.206 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 12.5 mt . . . . . 0 C--O 1.241 0.63 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -60.79 130.74 48.38 Favored Glycine 0 C--N 1.346 1.085 0 CA-C-O 119.074 -0.848 . . . . 0.0 111.906 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -64.29 -43.2 95.48 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.244 0.617 . . . . 0.0 111.104 -174.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 7.8 p -58.9 -35.04 54.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 123.199 0.6 . . . . 0.0 110.958 173.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.43 -43.71 76.82 Favored Glycine 0 C--N 1.345 1.082 0 O-C-N 123.647 0.592 . . . . 0.0 112.205 175.135 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -67.5 -47.87 68.75 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 124.024 0.93 . . . . 0.0 111.554 -176.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -67.66 -39.3 84.55 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.445 0.698 . . . . 0.0 110.806 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -70.75 -33.17 70.53 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 123.44 0.463 . . . . 0.0 110.129 179.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.63 HD22 HD21 ' A' ' 27' ' ' LEU . 2.5 mp -66.18 -41.33 90.43 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.344 0.658 . . . . 0.0 110.791 173.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 56.4 ttt180 -58.05 -42.96 86.55 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 123.656 0.597 . . . . 0.0 109.62 175.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.02 -39.71 75.65 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.42 1.088 . . . . 0.0 111.919 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.678 HG21 ' HB3' ' A' ' 20' ' ' GLN . 72.9 mt -68.69 -54.08 23.15 Favored 'Isoleucine or valine' 0 C--N 1.359 1.012 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -178.488 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -67.09 -23.27 65.83 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.331 1.052 . . . . 0.0 112.605 179.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.467 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -65.85 -54.56 25.1 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 170.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.486 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -58.81 -42.38 89.03 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 124.448 1.092 . . . . 0.0 111.339 -178.361 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.508 HD23 HD12 ' A' ' 76' ' ' ILE . 95.5 mt -68.04 -38.42 82.49 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.319 1.047 . . . . 0.0 111.721 179.469 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.34 -33.0 74.93 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.173 0.589 . . . . 0.0 110.394 174.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.467 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 80.5 mtt-85 -74.91 -27.4 60.2 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.588 0.755 . . . . 0.0 111.36 177.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.508 HD12 HD23 ' A' ' 73' ' ' LEU . 76.2 mt -69.89 -44.6 78.63 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 174.129 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.37 -32.97 74.88 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 114.825 -1.08 . . . . 0.0 111.324 176.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 26.6 t -84.08 -23.2 30.91 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.439 0.696 . . . . 0.0 111.627 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 86.95 16.63 60.86 Favored Glycine 0 C--N 1.35 1.31 0 O-C-N 123.298 0.374 . . . . 0.0 113.785 -178.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.4 t -114.36 18.83 16.68 Favored 'General case' 0 CA--C 1.559 1.291 0 C-N-CA 124.111 0.964 . . . . 0.0 111.372 178.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -72.66 137.61 46.15 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 170.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.453 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 88.5 11.42 66.37 Favored Glycine 0 CA--C 1.528 0.857 0 O-C-N 123.987 0.804 . . . . 0.0 111.918 -171.444 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 22.7 m -118.79 118.2 30.95 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.511 0.724 . . . . 0.0 109.656 175.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 46.5 t -74.2 92.84 2.26 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.898 171.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 27.0 m -66.84 -14.45 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 124.041 0.936 . . . . 0.0 112.755 -177.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 47.7 tttm -76.49 -17.41 59.3 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.152 0.581 . . . . 0.0 111.844 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 31.0 p -144.26 8.6 1.4 Allowed 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 176.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 62.43 32.38 82.82 Favored Glycine 0 C--N 1.358 1.759 0 C-N-CA 123.247 0.451 . . . . 0.0 114.196 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 32.3 mmmt -116.05 -171.39 1.98 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.499 0.72 . . . . 0.0 110.067 -176.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.453 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 24.2 tpp180 -89.12 151.42 22.22 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.176 0.991 . . . . 0.0 110.364 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 9.8 mm -92.5 138.74 19.32 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 165.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 39.0 m -73.92 151.38 40.41 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 122.619 0.368 . . . . 0.0 110.54 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -61.36 -41.43 97.06 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.405 0.682 . . . . 0.0 109.896 174.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.421 ' HA ' ' HG2' ' A' ' 97' ' ' LYS . 64.0 m-20 -67.13 -33.58 75.75 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.286 178.369 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.455 ' HG3' HG21 ' A' ' 102' ' ' THR . 1.0 OUTLIER -66.43 -44.1 83.81 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.42 0.688 . . . . 0.0 109.583 174.918 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 79.4 mt -71.19 -36.01 71.78 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.764 0.826 . . . . 0.0 112.037 -177.161 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.421 ' HG2' ' HA ' ' A' ' 94' ' ' ASP . 16.0 ptpt -77.08 -28.18 54.52 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 110.256 -0.275 . . . . 0.0 110.256 -177.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -79.12 -40.48 30.95 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.493 0.717 . . . . 0.0 110.732 175.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.2 p -152.61 94.3 3.19 Favored Pre-proline 0 CA--C 1.556 1.183 0 C-N-CA 124.625 1.17 . . . . 0.0 108.79 -176.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.98 -13.1 19.54 Favored 'Trans proline' 0 C--N 1.375 1.935 0 C-N-CA 122.61 2.207 . . . . 0.0 113.816 -179.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 36.2 p90 -90.69 7.71 38.12 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -179.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.455 HG21 ' HG3' ' A' ' 95' ' ' ARG . 15.0 t -82.74 123.77 77.9 Favored Pre-proline 0 CA--C 1.562 1.418 0 CA-C-N 118.112 0.415 . . . . 0.0 110.735 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -84.29 0.63 9.09 Favored 'Trans proline' 0 C--N 1.368 1.605 0 C-N-CA 122.61 2.207 . . . . 0.0 111.645 167.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -117.39 141.63 48.09 Favored 'General case' 0 C--N 1.353 0.744 0 C-N-CA 123.929 0.892 . . . . 0.0 110.577 -173.055 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.64 ' SG ' ' HG3' ' A' ' 107' ' ' GLU . 19.8 p -80.18 173.48 12.56 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 174.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -60.96 -35.08 75.84 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -172.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 0.64 ' HG3' ' SG ' ' A' ' 105' ' ' CYS . 0.0 OUTLIER -72.24 -32.64 66.88 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 178.48 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 91.8 m -73.87 -38.8 64.31 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 122.452 0.301 . . . . 0.0 110.784 173.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.91 -32.54 74.3 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.129 0.972 . . . . 0.0 111.187 175.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.25 -33.45 69.83 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.74 0.816 . . . . 0.0 110.708 174.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.835 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.852 177.799 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 16.7 m120 . . . . . 0 N--CA 1.486 1.369 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.401 HG22 ' HD2' ' A' ' 81' ' ' PHE . 37.7 t -50.04 -42.38 19.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 C-N-CA 124.535 1.134 . . . . 0.0 111.817 178.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -70.62 -36.17 73.33 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 123.855 0.722 . . . . 0.0 111.925 -175.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 57.5 m -68.3 -35.77 78.33 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 173.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.419 ' HA ' HG22 ' A' ' 15' ' ' ILE . 23.1 m-85 -70.3 -36.47 74.35 Favored 'General case' 0 C--O 1.215 -0.758 0 C-N-CA 123.252 0.621 . . . . 0.0 110.403 176.404 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -63.31 -52.19 62.92 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.207 1.003 . . . . 0.0 110.303 -175.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.82 -42.3 95.09 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.471 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.527 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 10.6 tt -69.2 -32.76 55.1 Favored 'Isoleucine or valine' 0 C--N 1.365 1.261 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 -177.039 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.45 ' HB3' HG23 ' A' ' 69' ' ' ILE . 52.8 mt -62.78 -41.87 99.44 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 122.793 0.437 . . . . 0.0 110.451 175.438 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.523 ' O ' ' HG2' ' A' ' 21' ' ' ARG . 17.4 mtm180 -60.83 -52.62 64.28 Favored 'General case' 0 C--O 1.215 -0.737 0 O-C-N 123.626 0.579 . . . . 0.0 109.448 175.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -53.95 -44.86 71.06 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.43 0.692 . . . . 0.0 111.422 -176.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.527 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -61.44 -51.21 69.67 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 124.306 1.004 . . . . 0.0 110.867 178.956 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.666 ' HB3' HG21 ' A' ' 69' ' ' ILE . 1.8 pt20 -67.83 -29.84 69.09 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 122.983 0.177 . . . . 0.0 110.941 -176.071 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.523 ' HG2' ' O ' ' A' ' 17' ' ' ARG . 29.2 mmt180 -71.41 -54.39 10.84 Favored 'General case' 0 C--N 1.354 0.781 0 C-N-CA 123.623 0.769 . . . . 0.0 110.131 -177.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -61.63 -29.93 70.37 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.109 0.564 . . . . 0.0 110.584 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.617 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 82.5 mt -69.83 -43.32 72.22 Favored 'General case' 0 C--O 1.212 -0.869 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.94 170.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.43 ' O ' ' HB2' ' A' ' 28' ' ' HIS . 2.0 m-85 -56.83 -37.15 70.84 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.099 0.56 . . . . 0.0 112.062 -177.612 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 35.7 ptt180 -80.46 -29.7 37.47 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 122.169 0.187 . . . . 0.0 111.172 174.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 47.7 ttt85 -66.83 -37.77 85.13 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.95 0.9 . . . . 0.0 112.23 177.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.617 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 1.7 pp -97.22 -35.48 10.74 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 122.473 0.309 . . . . 0.0 111.288 -177.203 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.43 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 52.1 m-70 . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 122.242 1.02 . . . . 0.0 109.341 168.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 12.4 mt . . . . . 0 N--CA 1.479 0.978 0 CA-C-O 120.596 0.236 . . . . 0.0 111.046 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -95.57 132.04 10.92 Favored Glycine 0 C--N 1.346 1.102 0 N-CA-C 110.85 -0.9 . . . . 0.0 110.85 172.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -51.62 -51.99 51.25 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 124.49 1.116 . . . . 0.0 112.906 -175.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 7.4 p -66.49 -32.15 56.75 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 C-N-CA 123.851 0.86 . . . . 0.0 111.003 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -63.46 -36.93 94.03 Favored Glycine 0 C--N 1.347 1.174 0 N-CA-C 111.903 -0.479 . . . . 0.0 111.903 175.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -76.99 -41.12 44.15 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.312 1.045 . . . . 0.0 111.552 -178.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -67.74 -39.06 84.25 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.533 0.733 . . . . 0.0 110.197 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -70.64 -39.7 73.52 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.545 178.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.1 mp -56.2 -47.2 78.84 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.024 0.929 . . . . 0.0 110.313 172.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -63.37 -37.32 86.8 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.704 0.802 . . . . 0.0 110.693 -176.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.75 -37.8 70.49 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.664 0.786 . . . . 0.0 111.182 178.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.666 HG21 ' HB3' ' A' ' 20' ' ' GLN . 85.4 mt -67.32 -52.24 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 123.973 0.909 . . . . 0.0 110.51 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.8 -29.74 70.72 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.24 1.016 . . . . 0.0 111.213 -179.17 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.405 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -65.4 -46.14 81.19 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 122.973 0.509 . . . . 0.0 110.043 173.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.51 ' HB1' ' HE1' ' A' ' 81' ' ' PHE . . . -66.42 -39.98 89.28 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.391 179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.512 HD23 HD12 ' A' ' 76' ' ' ILE . 68.3 mt -69.83 -32.17 70.45 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.06 0.944 . . . . 0.0 111.188 178.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.54 -34.82 79.14 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.348 0.659 . . . . 0.0 110.544 174.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.405 ' HG2' ' O ' ' A' ' 71' ' ' ALA . 17.8 mmt180 -72.04 -37.95 69.63 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.501 176.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.512 HD12 HD23 ' A' ' 73' ' ' LEU . 59.6 mt -65.69 -41.62 90.88 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 CA-C-O 121.224 0.535 . . . . 0.0 109.629 175.636 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -67.66 -25.06 65.52 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.438 1.095 . . . . 0.0 111.933 178.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 27.5 t -100.37 2.58 42.54 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 123.739 0.816 . . . . 0.0 111.084 177.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 66.51 19.64 69.06 Favored Glycine 0 C--N 1.358 1.771 0 N-CA-C 114.452 0.541 . . . . 0.0 114.452 176.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 9.0 t -127.4 29.2 5.57 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 124.519 1.127 . . . . 0.0 110.873 -177.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.51 ' HE1' ' HB1' ' A' ' 72' ' ' ALA . 68.5 t80 -59.35 143.67 48.84 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 122.821 0.449 . . . . 0.0 110.317 167.377 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 83.48 33.63 21.93 Favored Glycine 0 C--N 1.34 0.757 0 O-C-N 123.779 0.674 . . . . 0.0 111.623 -173.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 59.1 m -125.66 120.36 30.51 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.385 0.674 . . . . 0.0 110.074 175.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . 0.423 ' HB2' ' HB3' ' A' ' 105' ' ' CYS . 48.7 t -76.66 102.18 6.06 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 123.807 0.843 . . . . 0.0 110.613 175.131 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 16.4 m -74.2 -11.45 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 124.157 0.983 . . . . 0.0 112.408 -175.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 52.4 tttm -81.03 -24.83 37.61 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.073 0.549 . . . . 0.0 111.381 -178.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.439 ' SG ' ' HB2' ' A' ' 89' ' ' LYS . 23.3 p -139.01 11.3 2.62 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 -178.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 62.21 26.66 67.98 Favored Glycine 0 C--N 1.353 1.512 0 N-CA-C 114.0 0.36 . . . . 0.0 114.0 -179.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.439 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 85.5 mttt -103.66 -168.89 1.56 Allowed 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.373 0.669 . . . . 0.0 110.853 -179.251 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 1.8 tmt_? -96.98 159.56 14.84 Favored 'General case' 0 CA--C 1.559 1.322 0 C-N-CA 124.796 1.239 . . . . 0.0 107.718 176.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 9.1 mm -96.25 134.21 34.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 171.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.1 m -61.73 143.64 55.89 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.476 0.711 . . . . 0.0 110.314 177.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -66.25 -38.08 87.0 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 118.104 0.411 . . . . 0.0 110.724 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -57.76 -40.1 78.95 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.489 0.715 . . . . 0.0 110.786 173.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.581 ' HG3' HG21 ' A' ' 102' ' ' THR . 25.2 tpt180 -66.32 -42.28 88.43 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.427 176.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 83.9 mt -68.93 -38.15 79.34 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.784 0.834 . . . . 0.0 112.628 -176.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -78.67 -32.16 47.04 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 122.399 0.28 . . . . 0.0 110.339 -176.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.65 -38.14 65.07 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.469 0.708 . . . . 0.0 110.749 176.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 1.7 p -155.61 99.52 2.25 Favored Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 124.773 1.229 . . . . 0.0 108.911 -178.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -73.02 -15.88 25.83 Favored 'Trans proline' 0 C--N 1.371 1.73 0 C-N-CA 122.445 2.096 . . . . 0.0 113.173 176.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 19.5 p90 -95.0 64.68 2.83 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 122.251 1.025 . . . . 0.0 109.333 179.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.581 HG21 ' HG3' ' A' ' 95' ' ' ARG . 13.5 t -137.94 108.53 8.32 Favored Pre-proline 0 CA--C 1.559 1.315 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.061 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.28 -8.03 18.34 Favored 'Trans proline' 0 C--N 1.371 1.757 0 C-N-CA 122.668 2.245 . . . . 0.0 112.056 169.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -104.68 140.22 38.37 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.06 0.944 . . . . 0.0 109.558 -178.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.423 ' HB3' ' HB2' ' A' ' 84' ' ' CYS . 30.3 p -78.06 169.89 17.51 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 174.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -52.67 -37.72 59.22 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 123.518 0.727 . . . . 0.0 111.067 -178.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -57.85 -54.56 45.58 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.316 174.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 93.2 m -70.25 -26.82 64.01 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.387 -174.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.61 -44.05 87.76 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.78 0.832 . . . . 0.0 110.151 174.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -74.48 -20.1 60.13 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.439 177.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.058 0 C-N-CA 124.107 0.963 . . . . 0.0 112.578 -177.388 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.8 m120 . . . . . 0 N--CA 1.486 1.333 0 CA-C-O 121.107 0.48 . . . . 0.0 110.166 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 72.7 t -60.55 -37.58 75.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 123.95 0.9 . . . . 0.0 111.435 -178.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -69.27 -31.84 70.63 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.142 0.577 . . . . 0.0 111.008 -179.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.3 m -66.71 -39.67 88.12 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.224 0.609 . . . . 0.0 109.974 174.203 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -70.23 -37.57 75.01 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.257 176.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -60.4 -53.57 56.01 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.533 1.133 . . . . 0.0 110.25 -175.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -64.75 -45.04 88.14 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.758 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.451 ' O ' ' HB2' ' A' ' 19' ' ' ARG . 10.9 tt -66.11 -32.37 57.84 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.263 0 N-CA-C 110.28 -0.267 . . . . 0.0 110.28 -174.401 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.615 ' HB3' HG23 ' A' ' 69' ' ' ILE . 69.7 mt -73.27 -38.05 66.07 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.019 0.928 . . . . 0.0 111.136 177.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.619 ' HE ' HD13 ' A' ' 73' ' ' LEU . 15.2 mmt85 -64.49 -41.96 96.15 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.52 0.728 . . . . 0.0 111.109 175.267 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -69.13 -35.92 76.92 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.451 ' HB2' ' O ' ' A' ' 15' ' ' ILE . 8.4 tpt180 -65.99 -48.96 69.47 Favored 'General case' 0 C--N 1.346 0.448 0 CA-C-N 114.341 -1.3 . . . . 0.0 110.799 -177.294 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.669 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.8 pt20 -70.76 -33.83 71.2 Favored 'General case' 0 C--O 1.216 -0.696 0 CA-C-O 118.947 -0.549 . . . . 0.0 110.96 -174.194 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 17' ' ' ARG . 32.5 mmt180 -76.4 -38.39 55.72 Favored 'General case' 0 C--N 1.362 1.144 0 O-C-N 123.456 0.473 . . . . 0.0 111.951 -176.084 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -67.43 -40.72 85.48 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 177.14 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.557 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 97.1 mt -69.73 -36.25 75.69 Favored 'General case' 0 C--N 1.346 0.442 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.505 175.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.449 ' HB2' ' O ' ' A' ' 20' ' ' GLN . 0.2 OUTLIER -58.61 -54.74 43.63 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.84 0.856 . . . . 0.0 110.318 -178.02 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -69.11 -28.03 66.11 Favored 'General case' 0 CA--C 1.551 1.005 0 O-C-N 124.071 0.857 . . . . 0.0 110.815 -177.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 50.5 ttt85 -61.96 -55.04 33.49 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.826 0.85 . . . . 0.0 111.257 174.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.703 ' HB2' ' HA ' ' A' ' 58' ' ' LEU . 3.2 pp -82.51 -9.0 59.6 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 122.791 0.436 . . . . 0.0 111.904 -178.092 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 11.6 m170 . . . . . 0 N--CA 1.482 1.127 0 C-N-CA 123.987 0.915 . . . . 0.0 109.017 171.835 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.703 ' HA ' ' HB2' ' A' ' 27' ' ' LEU . 6.8 mp . . . . . 0 CA--C 1.539 0.553 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -77.97 149.25 34.21 Favored Glycine 0 C--N 1.346 1.117 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.784 -175.256 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -57.18 -49.35 76.25 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.551 1.141 . . . . 0.0 112.521 -175.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 9.8 p -61.06 -38.0 78.6 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.772 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.51 -51.38 31.68 Favored Glycine 0 C--N 1.348 1.23 0 O-C-N 123.704 0.628 . . . . 0.0 112.497 -179.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -64.1 -47.39 80.21 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.564 0.746 . . . . 0.0 111.235 -175.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.25 -22.86 59.14 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.751 -177.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -74.51 -44.81 49.55 Favored 'General case' 0 C--O 1.209 -1.035 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 173.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.44 HD11 ' HB2' ' A' ' 23' ' ' LEU . 5.1 mp -55.74 -43.24 76.44 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 124.122 0.969 . . . . 0.0 110.72 173.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 55.7 ttt180 -57.77 -45.93 85.28 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.252 1.021 . . . . 0.0 110.898 176.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -73.74 -33.47 64.34 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.438 -179.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.669 HG21 ' HB3' ' A' ' 20' ' ' GLN . 66.7 mt -69.18 -51.22 45.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.127 0.971 . . . . 0.0 109.226 -178.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -65.88 -27.04 67.92 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.182 0.993 . . . . 0.0 111.736 177.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.73 -42.82 81.26 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 122.792 0.437 . . . . 0.0 109.969 172.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.445 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -69.39 -39.71 77.82 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.773 0.829 . . . . 0.0 111.374 179.033 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.619 HD13 ' HE ' ' A' ' 17' ' ' ARG . 89.7 mt -72.68 -29.01 63.05 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.153 0.981 . . . . 0.0 110.939 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.36 -35.38 75.8 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.488 0.715 . . . . 0.0 110.164 173.211 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 67.2 mtm180 -64.32 -44.73 90.65 Favored 'General case' 0 C--N 1.355 0.846 0 O-C-N 123.6 0.563 . . . . 0.0 110.483 173.055 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.564 HD12 HD23 ' A' ' 73' ' ' LEU . 63.5 mt -63.35 -45.71 97.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 -179.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.78 -29.33 70.55 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.289 1.036 . . . . 0.0 111.717 179.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.517 ' HB3' HG22 ' A' ' 80' ' ' THR . 33.5 t -88.57 -12.3 43.1 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 123.964 0.906 . . . . 0.0 111.222 177.609 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 73.58 25.67 71.76 Favored Glycine 0 C--N 1.352 1.464 0 CA-C-N 116.768 -0.197 . . . . 0.0 112.868 -177.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.517 HG22 ' HB3' ' A' ' 78' ' ' SER . 14.7 t -123.62 25.82 8.01 Favored 'General case' 0 CA--C 1.556 1.209 0 C-N-CA 124.668 1.187 . . . . 0.0 110.375 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -66.18 140.87 58.22 Favored 'General case' 0 N--CA 1.477 0.913 0 O-C-N 121.538 -0.726 . . . . 0.0 110.232 171.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.406 ' HA2' HD11 ' A' ' 96' ' ' LEU . . . 83.63 27.6 38.28 Favored Glycine 0 C--N 1.342 0.906 0 O-C-N 123.732 0.645 . . . . 0.0 111.52 -171.005 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 94.3 m -116.09 122.05 44.0 Favored 'General case' 0 C--O 1.242 0.708 0 C-N-CA 123.656 0.783 . . . . 0.0 110.182 175.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . 0.664 ' SG ' ' SG ' ' A' ' 105' ' ' CYS . 13.1 t -66.51 95.96 0.35 Allowed 'General case' 0 C--N 1.348 0.528 0 C-N-CA 124.31 1.044 . . . . 0.0 108.623 173.434 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 11.8 m -63.29 -29.84 48.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 C-N-CA 123.991 0.916 . . . . 0.0 112.075 -170.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -72.09 -21.01 61.56 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.357 1.063 . . . . 0.0 111.081 -179.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 84' ' ' CYS . 6.5 m -119.63 -16.74 8.79 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.752 0.821 . . . . 0.0 112.276 -169.201 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 56.95 47.68 85.06 Favored Glycine 0 C--N 1.355 1.591 0 N-CA-C 111.316 -0.714 . . . . 0.0 111.316 -166.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -138.84 -157.58 0.78 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.572 1.149 . . . . 0.0 110.116 -171.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 11.4 tpt180 -97.64 145.78 25.96 Favored 'General case' 0 CA--C 1.564 1.485 0 C-N-CA 124.083 0.953 . . . . 0.0 112.47 -176.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 5.4 mm -95.01 148.77 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 164.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.8 m -75.44 144.54 42.1 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 174.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -61.67 -37.64 84.83 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.082 0.553 . . . . 0.0 110.326 175.154 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -62.15 -38.43 88.98 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.942 0.897 . . . . 0.0 111.378 177.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.451 ' HG3' HG21 ' A' ' 102' ' ' THR . 30.3 tpt180 -64.28 -40.51 96.12 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.413 175.492 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.406 HD11 ' HA2' ' A' ' 82' ' ' GLY . 97.3 mt -78.15 -32.38 50.24 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 -175.549 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -76.11 -28.18 57.39 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -77.64 -49.56 14.29 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.538 0.735 . . . . 0.0 110.421 173.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.426 ' O ' HG22 ' A' ' 102' ' ' THR . 2.2 p -144.86 96.59 5.04 Favored Pre-proline 0 CA--C 1.558 1.251 0 C-N-CA 124.703 1.201 . . . . 0.0 109.139 -178.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . 0.447 ' HG2' HD21 ' A' ' 16' ' ' LEU . 55.5 Cg_endo -73.45 -23.57 17.25 Favored 'Trans proline' 0 C--N 1.378 2.123 0 C-N-CA 122.542 2.162 . . . . 0.0 113.569 -179.056 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 46.5 p90 -81.95 -2.26 50.8 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -177.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.451 HG21 ' HG3' ' A' ' 95' ' ' ARG . 13.8 t -68.77 122.4 84.75 Favored Pre-proline 0 CA--C 1.558 1.279 0 CA-C-N 118.373 0.533 . . . . 0.0 110.708 -179.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.39 -27.72 18.95 Favored 'Trans proline' 0 C--N 1.371 1.735 0 C-N-CA 122.199 1.933 . . . . 0.0 111.782 173.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.411 ' HB2' ' HB2' ' A' ' 109' ' ' ALA . 12.7 m-85 -104.44 152.18 22.63 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.628 0.771 . . . . 0.0 110.735 -174.414 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.664 ' SG ' ' SG ' ' A' ' 84' ' ' CYS . 30.7 p -72.3 157.47 37.62 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 115.138 -0.937 . . . . 0.0 108.794 170.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.416 ' HB2' ' HD3' ' A' ' 95' ' ' ARG . 33.5 tt0 -51.1 -39.76 56.89 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.279 1.031 . . . . 0.0 112.16 -179.3 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -66.9 -48.32 69.08 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 124.182 0.993 . . . . 0.0 109.777 -177.074 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.649 ' SG ' ' SG ' ' A' ' 105' ' ' CYS . 85.0 m -82.54 -16.01 50.21 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 114.682 -1.145 . . . . 0.0 112.566 -174.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.411 ' HB2' ' HB2' ' A' ' 104' ' ' PHE . . . -85.23 -26.07 26.92 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.52 0.728 . . . . 0.0 109.942 171.249 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -77.59 -23.62 49.9 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.762 0.825 . . . . 0.0 110.175 170.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.886 0 C-N-CA 123.797 0.839 . . . . 0.0 111.738 174.918 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 . . . . . 0 CA--C 1.537 0.479 0 N-CA-C 110.502 -0.185 . . . . 0.0 110.502 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 55.4 t -66.54 -28.31 42.95 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 C-N-CA 123.408 0.683 . . . . 0.0 110.595 175.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -65.92 -38.9 89.88 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.968 0.907 . . . . 0.0 112.604 -176.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 60.3 p -64.48 -39.76 94.41 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 174.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -68.93 -32.56 72.26 Favored 'General case' 0 C--O 1.215 -0.74 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.184 177.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.552 ' HG2' HG21 ' A' ' 76' ' ' ILE . 1.4 tm-20 -60.31 -59.3 5.63 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.355 1.062 . . . . 0.0 109.374 -177.309 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt -66.81 -39.67 87.81 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 114.623 -1.171 . . . . 0.0 112.339 -174.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.461 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 12.5 tt -66.99 -38.43 81.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 -177.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.581 ' HB3' HG23 ' A' ' 69' ' ' ILE . 66.0 mt -67.84 -39.03 83.9 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 122.986 0.514 . . . . 0.0 111.368 178.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 38.3 mmt180 -61.93 -48.16 81.66 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.123 0.569 . . . . 0.0 110.439 178.165 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -62.48 -40.9 98.18 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.261 0.624 . . . . 0.0 110.78 178.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.482 ' HA ' ' HG2' ' A' ' 22' ' ' GLU . 6.3 mpt_? -72.02 -38.1 69.65 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.77 0.828 . . . . 0.0 112.151 -176.423 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.524 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.5 pt20 -68.56 -33.88 74.85 Favored 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.148 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' ' 17' ' ' ARG . 24.8 mmt180 -77.8 -30.3 51.21 Favored 'General case' 0 C--N 1.349 0.571 0 CA-C-O 118.972 -0.537 . . . . 0.0 112.159 -178.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.482 ' HG2' ' HA ' ' A' ' 19' ' ' ARG . 5.4 pt-20 -70.2 -33.82 72.17 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 174.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.57 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 88.1 mt -69.25 -47.58 64.28 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.404 172.315 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.464 ' O ' ' HB2' ' A' ' 28' ' ' HIS . 1.7 m-85 -56.88 -46.61 81.74 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.909 0.883 . . . . 0.0 111.137 -175.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.8 ptp180 -68.02 -37.0 80.89 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 122.96 0.504 . . . . 0.0 111.031 177.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.555 HH11 HD23 ' A' ' 23' ' ' LEU . 41.4 ttm180 -62.8 -43.08 99.73 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.037 0.935 . . . . 0.0 112.472 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 1.5 pp -94.67 -15.74 23.7 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.545 0.338 . . . . 0.0 111.836 -177.661 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.464 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 10.1 m170 . . . . . 0 N--CA 1.49 1.528 0 C-N-CA 123.386 0.674 . . . . 0.0 109.434 168.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.478 HD22 HD13 ' A' ' 27' ' ' LEU . 6.2 mt . . . . . 0 N--CA 1.473 0.712 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -79.18 151.17 34.62 Favored Glycine 0 C--N 1.348 1.242 0 CA-C-O 119.27 -0.739 . . . . 0.0 111.423 172.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -62.43 -51.67 66.62 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.26 0.624 . . . . 0.0 111.594 -176.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 8.4 p -60.74 -32.53 52.16 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 123.651 0.78 . . . . 0.0 111.21 175.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.523 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -60.5 -57.0 21.22 Favored Glycine 0 C--N 1.349 1.304 0 O-C-N 123.992 0.807 . . . . 0.0 111.439 175.542 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -63.41 -38.89 92.9 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 124.636 1.174 . . . . 0.0 111.473 -178.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -62.13 -53.25 57.98 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-N 114.85 -1.068 . . . . 0.0 109.66 -175.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -70.75 -34.23 71.64 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-N 114.044 -1.435 . . . . 0.0 109.874 -179.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.523 ' HB2' ' O ' ' A' ' 62' ' ' GLY . 14.8 tp -60.71 -53.51 56.58 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.699 1.2 . . . . 0.0 111.001 -178.121 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 80.5 ttt180 -76.16 -29.75 57.84 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 113.742 -1.572 . . . . 0.0 110.171 -173.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.4 -47.11 80.42 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.17 0.588 . . . . 0.0 110.263 173.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.581 HG23 ' HB3' ' A' ' 16' ' ' LEU . 74.7 mt -62.34 -48.19 89.51 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.661 175.444 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -68.8 -33.29 73.61 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.358 0.663 . . . . 0.0 110.374 -172.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.9 -41.45 74.69 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.382 0.673 . . . . 0.0 109.979 175.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.478 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -61.63 -41.44 97.48 Favored 'General case' 0 N--CA 1.481 1.115 0 O-C-N 123.882 0.739 . . . . 0.0 110.948 177.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.535 HD23 HD12 ' A' ' 76' ' ' ILE . 92.5 mt -67.93 -38.1 82.46 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.695 1.198 . . . . 0.0 111.53 177.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.67 -31.68 72.82 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.707 175.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -75.12 -33.64 61.59 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.748 0.819 . . . . 0.0 111.108 176.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.552 HG21 ' HG2' ' A' ' 13' ' ' GLU . 73.0 mt -63.33 -43.04 98.41 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 174.135 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.87 -41.02 99.23 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.166 175.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.433 ' HB3' HG22 ' A' ' 80' ' ' THR . 27.2 t -83.12 -6.64 59.56 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.86 0.864 . . . . 0.0 112.095 -175.075 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.63 26.19 73.55 Favored Glycine 0 C--N 1.354 1.569 0 CA-C-O 120.962 0.201 . . . . 0.0 112.814 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.433 HG22 ' HB3' ' A' ' 78' ' ' SER . 12.4 t -130.67 27.07 4.99 Favored 'General case' 0 CA--C 1.555 1.165 0 C-N-CA 124.59 1.156 . . . . 0.0 110.417 179.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -66.17 146.21 54.9 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 166.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.54 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 73.16 33.57 59.13 Favored Glycine 0 C--O 1.216 -0.998 0 O-C-N 123.667 0.604 . . . . 0.0 111.74 -174.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 88.2 m -122.09 146.69 46.96 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.337 0.655 . . . . 0.0 109.926 176.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 41.2 t -115.47 102.17 9.57 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.738 1.215 . . . . 0.0 109.082 176.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 27.3 m -65.49 -24.96 35.74 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 C-N-CA 123.887 0.875 . . . . 0.0 113.07 -174.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.546 ' HD2' ' HB3' ' A' ' 108' ' ' CYS . 22.0 ttmm -74.46 -11.05 60.13 Favored 'General case' 0 CA--C 1.559 1.312 0 C-N-CA 123.097 0.559 . . . . 0.0 112.249 -177.032 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 28.0 p -138.92 1.85 2.1 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.882 -0.511 . . . . 0.0 111.722 171.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 59.67 31.84 72.32 Favored Glycine 0 C--N 1.356 1.66 0 O-C-N 123.526 0.517 . . . . 0.0 114.179 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 50.4 mtpt -123.88 166.39 15.74 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-N 117.105 0.452 . . . . 0.0 111.215 -174.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.54 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 14.1 tpp180 -69.42 140.57 54.14 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 124.5 1.12 . . . . 0.0 110.876 -179.376 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 17.0 mm -75.54 150.67 6.6 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 123.762 0.825 . . . . 0.0 109.058 171.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 44.3 m -70.53 145.67 50.69 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 122.873 0.469 . . . . 0.0 109.769 173.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -58.75 -40.52 84.12 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.716 0.406 . . . . 0.0 110.05 174.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.481 ' HA ' ' HE3' ' A' ' 97' ' ' LYS . 36.4 m-20 -64.59 -32.9 74.75 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 114.964 -1.016 . . . . 0.0 111.454 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 4.8 tpm_? -70.72 -40.35 72.85 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.468 176.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 98.8 mt -72.39 -35.73 68.5 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 123.598 0.561 . . . . 0.0 111.932 -177.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.481 ' HE3' ' HA ' ' A' ' 94' ' ' ASP . 15.7 ptpt -74.86 -29.72 61.11 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -77.79 -39.58 43.5 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.585 0.754 . . . . 0.0 111.099 176.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.5 p -157.37 96.27 2.06 Favored Pre-proline 0 CA--C 1.557 1.216 0 C-N-CA 124.53 1.132 . . . . 0.0 109.15 -177.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . 0.449 ' HG2' HD21 ' A' ' 16' ' ' LEU . 89.3 Cg_endo -78.53 -1.15 11.35 Favored 'Trans proline' 0 C--N 1.378 2.118 0 C-N-CA 122.796 2.331 . . . . 0.0 113.467 -179.454 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 27.1 p90 -108.6 9.81 27.19 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -178.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 12.7 t -76.78 118.47 71.96 Favored Pre-proline 0 CA--C 1.561 1.401 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 175.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -76.75 -6.34 16.78 Favored 'Trans proline' 0 C--N 1.376 1.977 0 C-N-CA 122.552 2.168 . . . . 0.0 112.377 178.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.536 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 33.0 m-85 -130.19 159.03 38.08 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.663 0.785 . . . . 0.0 109.899 -177.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 17.8 p -82.38 165.03 20.65 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 176.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.5 tm0? -49.19 -40.33 32.88 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.597 0.759 . . . . 0.0 111.712 -173.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -56.97 -54.23 49.0 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.643 0.777 . . . . 0.0 111.632 177.274 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.546 ' HB3' ' HD2' ' A' ' 86' ' ' LYS . 61.8 m -78.74 -22.14 46.96 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.56 -173.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -81.27 -33.05 32.95 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.789 0.835 . . . . 0.0 109.998 179.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -78.78 -20.26 50.26 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.674 0.79 . . . . 0.0 110.655 173.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.854 0 C-N-CA 123.669 0.787 . . . . 0.0 112.165 176.303 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 18.7 m120 . . . . . 0 N--CA 1.482 1.137 0 CA-C-O 121.195 0.521 . . . . 0.0 111.591 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 59.1 t -56.67 -28.2 27.12 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.318 0 CA-C-N 114.174 -1.375 . . . . 0.0 112.028 -173.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.8 mp0 -62.85 -43.69 98.13 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 124.75 1.22 . . . . 0.0 111.117 -174.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.9 m -61.28 -44.91 96.46 Favored 'General case' 0 C--O 1.241 0.64 0 CA-C-N 114.757 -1.111 . . . . 0.0 109.936 175.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.516 ' HA ' HG22 ' A' ' 15' ' ' ILE . 27.8 m-85 -72.83 -29.99 63.67 Favored 'General case' 0 C--O 1.215 -0.733 0 CA-C-N 114.84 -1.073 . . . . 0.0 111.332 -178.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.486 ' HG2' HD13 ' A' ' 76' ' ' ILE . 3.4 tm-20 -65.42 -53.07 48.38 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 125.001 1.32 . . . . 0.0 109.002 -174.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.6 ptmm? -67.32 -43.17 82.29 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 114.81 -1.087 . . . . 0.0 111.603 -179.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.516 HG22 ' HA ' ' A' ' 12' ' ' TYR . 13.2 tt -69.54 -29.45 41.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 CA-C-O 120.779 0.324 . . . . 0.0 110.891 -174.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.447 ' HB3' HG23 ' A' ' 69' ' ' ILE . 41.0 mt -64.15 -46.65 83.12 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.736 171.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -64.25 -38.69 91.94 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 123.424 0.453 . . . . 0.0 111.274 178.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -58.66 -51.47 69.78 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.101 0.56 . . . . 0.0 109.661 177.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -64.53 -40.22 95.21 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 124.267 0.979 . . . . 0.0 111.189 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.526 ' HB2' HG21 ' A' ' 69' ' ' ILE . 3.9 tt0 -66.11 -44.62 83.78 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.268 0.627 . . . . 0.0 111.368 -179.109 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.515 ' O ' ' HG2' ' A' ' 25' ' ' ARG . 17.9 mmt180 -76.22 -36.0 58.78 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 119.101 -0.476 . . . . 0.0 111.07 -172.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -68.57 -38.45 80.73 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 123.684 0.615 . . . . 0.0 110.144 175.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.424 HD22 ' HA2' ' A' ' 62' ' ' GLY . 67.2 mt -67.18 -40.61 86.59 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 122.786 0.435 . . . . 0.0 110.674 175.018 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -55.41 -58.11 9.1 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 124.267 0.98 . . . . 0.0 109.964 -175.076 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.515 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 8.1 ptm180 -64.65 -34.73 78.97 Favored 'General case' 0 CA--C 1.559 1.316 0 O-C-N 124.036 0.835 . . . . 0.0 111.71 177.123 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -63.73 -41.22 98.08 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 123.784 0.834 . . . . 0.0 112.489 -178.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.686 HD21 HD22 ' A' ' 66' ' ' LEU . 4.3 pp -89.8 -23.7 21.66 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 122.88 0.472 . . . . 0.0 110.061 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 67.1 m-70 . . . . . 0 N--CA 1.484 1.252 0 C-N-CA 123.328 0.651 . . . . 0.0 109.99 167.829 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.482 HD12 HE21 ' A' ' 63' ' ' GLN . 18.2 mt . . . . . 0 C--O 1.241 0.628 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -64.08 129.84 38.26 Favored Glycine 0 C--N 1.347 1.161 0 CA-C-O 119.244 -0.753 . . . . 0.0 111.483 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -63.84 -40.82 97.49 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.853 0.861 . . . . 0.0 112.235 -175.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 62.3 t -57.53 -39.23 68.07 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 C-N-CA 123.688 0.795 . . . . 0.0 109.518 173.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.544 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -63.87 -57.36 14.37 Favored Glycine 0 C--N 1.344 1.021 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.427 177.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.482 HE21 HD12 ' A' ' 58' ' ' LEU . 98.2 mt-30 -58.48 -42.86 88.51 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 124.966 1.306 . . . . 0.0 112.109 -175.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -70.19 -50.9 35.47 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.24 -173.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -62.78 -37.58 87.25 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.421 178.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.686 HD22 HD21 ' A' ' 27' ' ' LEU . 10.4 tp -58.27 -49.53 76.79 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.951 1.301 . . . . 0.0 109.963 178.368 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -66.74 -33.83 76.5 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.925 -176.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.34 -35.02 75.49 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.522 0.729 . . . . 0.0 110.571 175.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.526 HG21 ' HB2' ' A' ' 20' ' ' GLN . 97.3 mt -68.36 -54.21 23.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 123.731 0.813 . . . . 0.0 110.314 176.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -59.53 -32.14 70.04 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 124.918 1.287 . . . . 0.0 112.11 178.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.477 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -65.14 -46.61 80.24 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.303 0.641 . . . . 0.0 109.647 174.142 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.468 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -69.01 -36.18 77.5 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.702 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.576 HD23 HD12 ' A' ' 76' ' ' ILE . 73.8 mt -71.2 -34.06 70.52 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 124.165 0.986 . . . . 0.0 110.163 177.605 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.85 -36.77 85.01 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.131 173.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.477 ' HG2' ' O ' ' A' ' 71' ' ' ALA . 4.9 mmp_? -67.5 -35.96 80.14 Favored 'General case' 0 C--O 1.216 -0.707 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.839 175.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.576 HD12 HD23 ' A' ' 73' ' ' LEU . 64.7 mt -68.47 -43.34 83.97 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 CA-C-O 121.031 0.443 . . . . 0.0 110.385 179.004 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.7 -28.71 68.65 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.22 177.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.5 t -87.54 -15.9 36.17 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.786 0.834 . . . . 0.0 111.321 175.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 82.22 5.64 89.46 Favored Glycine 0 C--N 1.35 1.333 0 C-N-CA 123.187 0.422 . . . . 0.0 113.992 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.434 HG23 ' HD3' ' A' ' 75' ' ' ARG . 13.3 t -109.89 30.07 7.04 Favored 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 124.369 1.067 . . . . 0.0 110.538 -177.053 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.453 ' HE1' ' HB1' ' A' ' 72' ' ' ALA . 79.7 t80 -63.99 147.68 51.46 Favored 'General case' 0 N--CA 1.479 0.981 0 O-C-N 121.958 -0.464 . . . . 0.0 111.38 171.054 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 71.07 42.57 58.71 Favored Glycine 0 C--N 1.347 1.184 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.263 -175.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 98.0 m -129.61 122.28 28.77 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.34 1.056 . . . . 0.0 110.152 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . 0.451 ' HB2' ' HB3' ' A' ' 105' ' ' CYS . 47.3 t -76.49 100.12 5.15 Favored 'General case' 0 C--N 1.351 0.649 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 170.513 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 35.4 m -60.38 -29.06 43.51 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 O-C-N 124.318 1.011 . . . . 0.0 111.628 177.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.503 ' HD3' ' SG ' ' A' ' 108' ' ' CYS . 47.6 tttm -77.23 -6.28 52.48 Favored 'General case' 0 CA--C 1.56 1.351 0 C-N-CA 124.296 1.038 . . . . 0.0 111.665 -177.392 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 63.1 m -124.26 -33.96 2.99 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.981 0.913 . . . . 0.0 112.37 177.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 87.31 6.5 78.0 Favored Glycine 0 CA--C 1.537 1.415 0 N-CA-C 111.874 -0.49 . . . . 0.0 111.874 -160.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -96.34 -172.21 2.47 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.379 1.071 . . . . 0.0 111.233 -174.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 26.6 mmt85 -91.45 163.05 14.31 Favored 'General case' 0 C--O 1.244 0.791 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.467 169.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 20.1 mm -92.45 142.95 12.36 Favored 'Isoleucine or valine' 0 C--O 1.244 0.767 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 163.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 44.2 m -68.29 144.16 54.95 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 175.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -61.02 -36.45 79.55 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 122.625 0.37 . . . . 0.0 110.169 174.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -59.15 -40.88 86.92 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.304 1.042 . . . . 0.0 110.332 175.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.414 ' HE ' ' HA ' ' A' ' 95' ' ' ARG . 0.2 OUTLIER -71.37 -38.16 71.57 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.559 177.056 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 73.2 mt -70.44 -35.42 73.36 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.613 0.765 . . . . 0.0 112.031 -177.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -79.24 -27.45 42.41 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -78.97 -27.88 43.54 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.004 0.922 . . . . 0.0 111.231 174.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.9 p -170.86 99.3 0.42 Allowed Pre-proline 0 CA--C 1.561 1.367 0 C-N-CA 124.937 1.295 . . . . 0.0 109.212 -178.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -75.55 -12.59 20.45 Favored 'Trans proline' 0 C--N 1.375 1.924 0 C-N-CA 122.366 2.044 . . . . 0.0 112.675 176.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 12.6 p90 -101.86 57.89 0.83 Allowed 'General case' 0 C--O 1.24 0.587 0 C-N-CA 124.215 1.006 . . . . 0.0 109.599 -179.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 11.9 t -131.88 117.26 16.09 Favored Pre-proline 0 CA--C 1.552 1.057 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.876 174.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -77.4 -4.77 15.05 Favored 'Trans proline' 0 C--N 1.375 1.923 0 C-N-CA 122.65 2.233 . . . . 0.0 112.134 171.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.449 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 16.2 m-85 -116.02 138.5 51.16 Favored 'General case' 0 C--N 1.353 0.753 0 C-N-CA 123.932 0.893 . . . . 0.0 110.369 -173.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.494 ' SG ' ' HB2' ' A' ' 107' ' ' GLU . 22.0 p -72.64 168.97 17.57 Favored 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 174.157 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -52.94 -37.75 61.27 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.802 0.841 . . . . 0.0 111.861 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 0.494 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 24.8 mt-10 -54.82 -53.47 54.77 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 124.211 1.004 . . . . 0.0 110.63 176.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.503 ' SG ' ' HD3' ' A' ' 86' ' ' LYS . 87.8 m -71.39 -38.59 71.48 Favored 'General case' 0 C--O 1.214 -0.775 0 CA-C-N 114.563 -1.199 . . . . 0.0 111.28 -176.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.95 -21.35 66.82 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.35 0.66 . . . . 0.0 111.216 176.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -85.07 -31.41 23.4 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.493 0.717 . . . . 0.0 111.291 172.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.98 0 C-N-CA 123.517 0.727 . . . . 0.0 111.28 -176.278 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.3 t30 . . . . . 0 CA--C 1.545 0.78 0 CA-C-O 120.795 0.331 . . . . 0.0 111.555 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 39.8 t -61.32 -26.94 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.407 178.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -62.63 -40.54 97.3 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 124.305 1.042 . . . . 0.0 110.691 175.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.5 m -59.27 -44.18 92.46 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 121.052 0.453 . . . . 0.0 110.406 175.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -71.38 -32.5 68.54 Favored 'General case' 0 C--N 1.347 0.494 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.738 -179.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -62.49 -57.0 12.76 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.182 0.993 . . . . 0.0 109.292 -179.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 18.2 ptmt -66.76 -39.28 87.82 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 123.899 0.75 . . . . 0.0 112.404 -174.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 14.0 tt -63.37 -34.37 66.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 -179.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.509 ' HB3' HG23 ' A' ' 69' ' ' ILE . 80.4 mt -70.61 -33.67 71.29 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 122.927 0.491 . . . . 0.0 111.843 175.577 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.02 -46.24 85.35 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 122.964 0.505 . . . . 0.0 109.733 176.383 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -60.95 -49.94 75.43 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.775 0.83 . . . . 0.0 111.062 176.208 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.462 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 3.5 mpt_? -66.0 -37.3 85.57 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 115.168 -0.923 . . . . 0.0 111.778 -174.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.615 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.5 pt20 -70.72 -40.64 72.7 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 117.996 0.362 . . . . 0.0 110.389 -177.667 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 91.5 mtt-85 -79.39 -30.31 42.42 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 112.427 0.528 . . . . 0.0 112.427 -175.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -68.4 -31.06 70.15 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 172.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.492 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 97.7 mt -66.89 -51.34 56.58 Favored 'General case' 0 C--N 1.352 0.709 0 CA-C-O 119.113 -0.47 . . . . 0.0 110.232 170.326 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -49.83 -51.67 38.18 Favored 'General case' 0 N--CA 1.483 1.209 0 O-C-N 124.303 1.002 . . . . 0.0 111.923 -177.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.3 ptp85 -64.63 -38.66 91.77 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 123.306 0.379 . . . . 0.0 111.248 177.131 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -65.16 -33.53 76.24 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.581 0.752 . . . . 0.0 112.322 -177.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 4.1 pp -103.39 -17.03 15.43 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -175.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 71.4 m-70 . . . . . 0 N--CA 1.486 1.33 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 167.353 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.437 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 59.3 mt . . . . . 0 CA--C 1.558 1.267 0 N-CA-C 114.423 1.268 . . . . 0.0 114.423 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 159.41 101.69 0.17 Allowed Glycine 0 C--N 1.342 0.91 0 N-CA-C 110.149 -1.18 . . . . 0.0 110.149 -172.029 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -48.16 -53.33 17.15 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 124.552 1.141 . . . . 0.0 113.363 -168.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.48 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 95.1 t -57.59 -44.1 84.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 O-C-N 124.061 0.851 . . . . 0.0 110.425 -179.353 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -67.97 -33.36 79.14 Favored Glycine 0 C--N 1.347 1.179 0 O-C-N 123.98 0.8 . . . . 0.0 113.394 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -72.08 -43.67 64.47 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.521 0.728 . . . . 0.0 110.62 -179.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -70.22 -35.73 74.06 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.867 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.48 ' HB2' ' O ' ' A' ' 61' ' ' VAL . 2.1 tp10 -66.39 -47.56 72.92 Favored 'General case' 0 C--N 1.349 0.554 0 CA-C-N 114.866 -1.061 . . . . 0.0 109.145 179.362 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 10.5 mt -51.33 -46.82 62.77 Favored 'General case' 0 N--CA 1.482 1.134 0 O-C-N 124.544 1.153 . . . . 0.0 110.999 173.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -64.01 -36.77 85.08 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.644 -176.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -74.76 -33.71 62.36 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.843 0.857 . . . . 0.0 111.469 177.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.615 HG21 ' HB3' ' A' ' 20' ' ' GLN . 69.9 mt -69.16 -55.85 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.782 0.833 . . . . 0.0 110.078 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -66.59 -21.91 66.13 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.567 1.147 . . . . 0.0 112.221 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.82 -49.81 71.4 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 121.275 0.559 . . . . 0.0 109.818 170.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.467 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -66.59 -41.51 88.37 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.244 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.433 HD21 ' HB2' ' A' ' 16' ' ' LEU . 79.6 mt -63.36 -41.26 98.82 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 124.386 1.074 . . . . 0.0 111.707 178.669 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.18 -40.17 84.81 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.762 0.825 . . . . 0.0 110.347 174.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 79.5 mtt85 -76.07 -23.11 55.01 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 115.087 -0.96 . . . . 0.0 112.731 -179.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 72' ' ' ALA . 85.3 mt -71.68 -44.34 69.45 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 173.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.42 -33.13 75.02 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.753 176.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 26.0 t -83.17 -19.35 36.75 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.67 0.788 . . . . 0.0 111.279 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 84.83 10.26 79.34 Favored Glycine 0 C--N 1.349 1.281 0 C-N-CA 122.924 0.297 . . . . 0.0 113.747 179.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.7 t -113.84 30.81 6.98 Favored 'General case' 0 CA--C 1.558 1.269 0 C-N-CA 123.92 0.888 . . . . 0.0 110.441 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -67.37 147.29 53.12 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 122.014 -0.429 . . . . 0.0 110.41 171.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.484 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 74.61 44.61 25.77 Favored Glycine 0 C--N 1.345 1.068 0 O-C-N 123.551 0.532 . . . . 0.0 111.823 -177.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 85.5 m -123.13 123.01 39.86 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.7 0.8 . . . . 0.0 110.366 179.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . 0.789 ' HG ' ' HG ' ' A' ' 87' ' ' CYS . 22.4 t -70.34 89.51 0.67 Allowed 'General case' 0 C--N 1.353 0.735 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 170.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 15.2 m -63.56 -30.27 49.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.832 0.853 . . . . 0.0 112.3 -169.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 57.1 tttm -69.23 -20.2 63.95 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.203 1.001 . . . . 0.0 111.128 179.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.789 ' HG ' ' HG ' ' A' ' 84' ' ' CYS . 7.0 m -119.49 -16.47 8.9 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.089 0.955 . . . . 0.0 111.386 -173.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 65.54 21.6 68.97 Favored Glycine 0 CA--C 1.539 1.562 0 C-N-CA 122.937 0.303 . . . . 0.0 112.956 -168.148 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -104.35 -170.2 1.73 Allowed 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.582 1.153 . . . . 0.0 110.987 -174.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.484 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 13.2 tpp180 -91.7 154.88 18.69 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.347 1.059 . . . . 0.0 110.494 178.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 31.8 mm -98.05 149.34 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 168.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.7 m -73.97 145.43 44.65 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.833 0.853 . . . . 0.0 109.526 175.121 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.424 ' HG2' ' HZ3' ' A' ' 97' ' ' LYS . 33.5 tt0 -62.63 -30.84 71.66 Favored 'General case' 0 N--CA 1.482 1.125 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 174.596 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.528 ' HA ' ' HE2' ' A' ' 97' ' ' LYS . 17.7 m-20 -62.36 -41.75 98.85 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.297 1.039 . . . . 0.0 111.295 175.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.435 ' HG3' HG21 ' A' ' 102' ' ' THR . 21.9 tpt180 -68.71 -40.55 79.91 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.1 176.766 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 94.4 mt -71.44 -32.24 68.11 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.152 0.581 . . . . 0.0 112.41 -177.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.528 ' HE2' ' HA ' ' A' ' 94' ' ' ASP . 0.2 OUTLIER -78.13 -32.2 50.29 Favored 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -179.502 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.37 -41.33 56.63 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.003 0.921 . . . . 0.0 110.737 176.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.4 p -153.45 98.48 2.7 Favored Pre-proline 0 CA--C 1.556 1.175 0 C-N-CA 124.906 1.282 . . . . 0.0 108.803 -176.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_exo -68.73 -24.93 34.26 Favored 'Trans proline' 0 C--N 1.371 1.756 0 C-N-CA 122.584 2.189 . . . . 0.0 112.28 173.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 9.1 p90 -89.53 58.63 4.43 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.652 1.181 . . . . 0.0 109.988 -178.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.435 HG21 ' HG3' ' A' ' 95' ' ' ARG . 10.9 t -123.83 104.15 33.44 Favored Pre-proline 0 CA--C 1.559 1.294 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.684 -175.143 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -67.35 -36.63 20.09 Favored 'Trans proline' 0 C--N 1.378 2.126 0 C-N-CA 122.474 2.116 . . . . 0.0 111.839 174.191 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -99.69 174.73 6.09 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -178.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.695 ' SG ' ' SG ' ' A' ' 108' ' ' CYS . 24.9 p -98.38 179.09 4.83 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.343 0.657 . . . . 0.0 109.301 176.243 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -54.52 -56.88 14.34 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.739 0.816 . . . . 0.0 111.768 -179.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -69.32 -39.67 78.07 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.933 -176.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.695 ' SG ' ' SG ' ' A' ' 105' ' ' CYS . 80.6 m -78.66 -21.8 47.76 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -176.075 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -76.21 -33.12 59.26 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 171.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.87 -23.12 59.55 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.648 172.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . 0.439 ' HB3' ' HA ' ' A' ' 108' ' ' CYS . . . . . . . . 0 N--CA 1.476 0.861 0 C-N-CA 124.28 1.032 . . . . 0.0 112.048 -176.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 8.5 m120 . . . . . 0 N--CA 1.473 0.715 0 CA-C-O 121.235 0.541 . . . . 0.0 111.845 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 21.9 t -70.7 -29.1 36.58 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 CA-C-N 115.344 -0.844 . . . . 0.0 109.791 176.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -68.77 -38.07 79.8 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.668 0.787 . . . . 0.0 111.183 178.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 27.8 m -63.45 -37.99 89.43 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.815 174.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.413 ' HA ' HG22 ' A' ' 15' ' ' ILE . 21.0 m-85 -70.8 -34.22 71.52 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.861 175.665 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.495 ' HG2' HG21 ' A' ' 76' ' ' ILE . 4.7 mm-40 -55.42 -59.23 5.1 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 124.107 0.963 . . . . 0.0 109.963 178.749 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.2 ptmt -66.82 -45.64 77.67 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.858 -174.234 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.51 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 12.3 tt -64.3 -36.04 75.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 CA-C-N 117.861 0.301 . . . . 0.0 110.624 -174.354 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.596 ' HB3' HG23 ' A' ' 69' ' ' ILE . 63.1 mt -66.67 -38.08 86.08 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.227 0.611 . . . . 0.0 110.82 176.597 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.45 ' HA ' ' HG2' ' A' ' 20' ' ' GLN . 96.2 mtt-85 -72.18 -26.08 61.93 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 123.513 0.508 . . . . 0.0 111.57 178.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 53.5 m-20 -74.2 -40.06 62.73 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 122.872 0.469 . . . . 0.0 110.305 173.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.51 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -67.22 -40.13 86.35 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.416 177.183 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.624 ' HB3' HG21 ' A' ' 69' ' ' ILE . 1.3 pt20 -71.37 -31.07 66.89 Favored 'General case' 0 C--O 1.204 -1.303 0 CA-C-O 118.906 -0.569 . . . . 0.0 109.691 178.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -56.2 -54.58 43.54 Favored 'General case' 0 N--CA 1.496 1.862 0 CA-C-N 118.618 0.645 . . . . 0.0 110.548 174.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -67.9 -35.22 78.11 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.857 -176.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.543 ' HA ' ' HG2' ' A' ' 26' ' ' ARG . 97.8 mt -69.11 -50.62 46.44 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 122.792 0.437 . . . . 0.0 111.396 176.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -51.24 -46.0 62.18 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 124.513 1.125 . . . . 0.0 111.026 -178.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.1 ptm180 -75.17 -32.61 61.32 Favored 'General case' 0 CA--C 1.549 0.923 0 O-C-N 123.428 0.455 . . . . 0.0 111.779 -179.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.543 ' HG2' ' HA ' ' A' ' 23' ' ' LEU . 6.3 ptm180 -74.01 -27.27 60.88 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-N 118.075 0.398 . . . . 0.0 111.417 -177.614 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.0 pp -89.56 -31.99 17.35 Favored 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 110.04 -0.355 . . . . 0.0 110.04 176.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 55.4 m-70 . . . . . 0 N--CA 1.485 1.28 0 C-N-CA 123.146 0.578 . . . . 0.0 110.276 169.065 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.421 HD12 HE21 ' A' ' 63' ' ' GLN . 35.9 mt . . . . . 0 C--O 1.241 0.652 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -65.14 142.48 44.77 Favored Glycine 0 C--N 1.347 1.185 0 CA-C-O 119.524 -0.598 . . . . 0.0 112.309 178.267 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -58.34 -50.78 72.4 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.311 1.044 . . . . 0.0 111.286 -179.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 11.2 p -61.89 -33.66 59.06 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.261 177.042 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -67.23 -51.84 35.64 Favored Glycine 0 C--N 1.347 1.16 0 O-C-N 123.905 0.753 . . . . 0.0 112.443 -178.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.421 HE21 HD12 ' A' ' 58' ' ' LEU . 99.5 mt-30 -62.33 -43.87 97.82 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.06 0.944 . . . . 0.0 111.162 -179.581 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -65.27 -48.04 74.6 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.973 -177.18 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -77.35 -27.38 52.69 Favored 'General case' 0 C--O 1.216 -0.669 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.83 -175.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.3 mp -59.72 -47.19 86.62 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-O 121.544 0.688 . . . . 0.0 109.286 169.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 40.0 ttt180 -60.57 -37.56 81.7 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 114.33 -1.304 . . . . 0.0 110.318 -178.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.33 -39.72 59.14 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.191 0.997 . . . . 0.0 111.741 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.624 HG21 ' HB3' ' A' ' 20' ' ' GLN . 67.8 mt -74.68 -57.87 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 123.713 0.805 . . . . 0.0 110.274 -177.288 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -56.2 -33.54 65.42 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.218 1.007 . . . . 0.0 111.79 177.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.444 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -63.53 -51.33 65.92 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 110.269 -0.271 . . . . 0.0 110.269 171.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.481 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -58.57 -44.78 89.87 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.942 0.897 . . . . 0.0 111.588 -177.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.431 HD21 ' HB2' ' A' ' 16' ' ' LEU . 95.8 mt -64.68 -38.43 90.96 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 124.745 1.218 . . . . 0.0 111.463 179.13 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.75 -33.38 74.74 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.728 176.302 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.451 ' NH1' HG11 ' A' ' 85' ' ' VAL . 79.8 mtt-85 -74.84 -25.49 59.03 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.511 0.724 . . . . 0.0 111.051 177.181 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.495 HG21 ' HG2' ' A' ' 13' ' ' GLU . 82.7 mt -70.91 -46.43 68.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 172.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.36 -25.79 68.19 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.861 0.864 . . . . 0.0 111.347 176.359 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.9 t -83.9 -29.57 27.07 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.941 0.896 . . . . 0.0 111.133 174.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 84.94 14.8 68.82 Favored Glycine 0 C--N 1.349 1.297 0 C-N-CA 123.034 0.35 . . . . 0.0 113.421 -176.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 15.3 t -106.13 7.57 31.74 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 123.809 0.844 . . . . 0.0 110.819 178.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -67.55 145.47 54.87 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 171.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.413 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 83.68 12.91 76.8 Favored Glycine 0 C--N 1.344 0.972 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.864 -171.19 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 43.4 m -130.39 119.18 22.34 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.217 1.007 . . . . 0.0 109.792 175.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 41.9 t -64.28 100.56 0.35 Allowed 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.9 0.88 . . . . 0.0 109.314 171.361 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.451 HG11 ' NH1' ' A' ' 75' ' ' ARG . 24.9 m -67.4 -23.61 30.34 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.918 0 C-N-CA 123.841 0.856 . . . . 0.0 111.782 -179.616 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 42.4 tttm -70.48 -17.56 62.97 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.598 0.759 . . . . 0.0 110.86 174.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 54.3 m -112.14 -29.39 7.6 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 124.295 1.038 . . . . 0.0 111.811 177.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 69.4 22.24 76.31 Favored Glycine 0 CA--C 1.539 1.58 0 CA-C-N 116.176 -0.465 . . . . 0.0 112.406 -162.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -126.09 174.38 8.52 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 124.674 1.19 . . . . 0.0 109.209 -174.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.413 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 13.3 tpp180 -67.04 158.23 31.53 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 124.708 1.203 . . . . 0.0 112.629 -173.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 13.1 mm -100.19 146.37 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 N-CA-C 107.786 -1.191 . . . . 0.0 107.786 164.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.7 m -72.36 140.97 48.75 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 173.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -63.72 -29.25 70.49 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 175.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -55.66 -49.68 72.25 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.658 1.183 . . . . 0.0 110.117 173.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.474 ' HG3' HG21 ' A' ' 102' ' ' THR . 26.2 tpt180 -62.19 -46.41 89.04 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 113.907 -1.497 . . . . 0.0 110.804 178.407 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 97.1 mt -66.22 -39.74 89.81 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.538 0.735 . . . . 0.0 112.087 -175.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -74.87 -32.03 61.76 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 122.353 0.261 . . . . 0.0 110.435 -176.221 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -79.3 -43.16 24.19 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.645 0.778 . . . . 0.0 111.192 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.1 p -148.2 95.32 4.12 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 124.724 1.21 . . . . 0.0 108.473 -177.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -79.64 -6.5 14.44 Favored 'Trans proline' 0 C--N 1.371 1.714 0 C-N-CA 122.382 2.055 . . . . 0.0 113.579 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 20.0 p90 -95.54 47.83 1.13 Allowed 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 121.732 0.777 . . . . 0.0 110.282 177.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.474 HG21 ' HG3' ' A' ' 95' ' ' ARG . 13.3 t -125.75 111.11 25.13 Favored Pre-proline 0 CA--C 1.559 1.302 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.241 178.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo -74.91 -13.48 21.63 Favored 'Trans proline' 0 C--N 1.369 1.651 0 C-N-CA 122.552 2.168 . . . . 0.0 111.834 169.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.415 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 10.8 m-85 -104.4 156.76 17.66 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.425 1.09 . . . . 0.0 110.331 -176.127 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 30.6 p -83.8 171.1 13.45 Favored 'General case' 0 N--CA 1.481 1.113 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 172.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -59.8 -35.55 74.91 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.46 0.704 . . . . 0.0 111.057 -176.017 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -58.03 -54.41 47.29 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 114.902 -1.045 . . . . 0.0 110.738 173.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.415 ' HB2' ' HB3' ' A' ' 104' ' ' PHE . 79.9 m -64.91 -35.8 82.3 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 123.885 0.741 . . . . 0.0 111.485 -178.544 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -63.72 -45.28 90.65 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.889 0.875 . . . . 0.0 110.258 -179.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.67 -20.39 61.25 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.344 177.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.804 0 C-N-CA 124.006 0.922 . . . . 0.0 112.227 -179.634 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 13.2 m120 . . . . . 0 N--CA 1.476 0.857 0 CA-C-O 121.12 0.486 . . . . 0.0 111.408 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 59.3 t -62.85 -36.04 73.76 Favored 'Isoleucine or valine' 0 C--N 1.351 0.671 0 C-N-CA 123.629 0.772 . . . . 0.0 110.342 -178.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -60.77 -38.81 86.53 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.962 0.905 . . . . 0.0 111.948 -179.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 28.5 m -64.92 -44.34 89.83 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.505 0.722 . . . . 0.0 110.004 175.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.404 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 29.4 m-85 -69.47 -32.55 71.53 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.143 179.198 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -64.55 -54.92 24.54 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.438 1.095 . . . . 0.0 109.632 -176.167 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.01 -38.76 89.26 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.733 -176.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 12.6 tt -69.66 -31.36 48.43 Favored 'Isoleucine or valine' 0 C--N 1.362 1.113 0 N-CA-C 110.29 -0.263 . . . . 0.0 110.29 -179.176 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.555 ' HB3' HG23 ' A' ' 69' ' ' ILE . 55.3 mt -70.96 -38.51 72.79 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.273 0.629 . . . . 0.0 111.147 176.262 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.47 ' O ' ' HG3' ' A' ' 21' ' ' ARG . 1.3 mmp_? -59.63 -46.76 88.04 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 123.694 0.621 . . . . 0.0 110.049 176.009 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.494 ' HA ' ' HD2' ' A' ' 21' ' ' ARG . 3.8 m-20 -73.25 -32.9 64.98 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -69.04 -40.14 78.76 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 122.8 0.44 . . . . 0.0 110.639 179.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.642 ' HB3' HG21 ' A' ' 69' ' ' ILE . 3.5 pt20 -72.46 -31.38 65.38 Favored 'General case' 0 C--O 1.2 -1.54 0 CA-C-O 118.594 -0.717 . . . . 0.0 109.715 176.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.494 ' HD2' ' HA ' ' A' ' 18' ' ' ASP . 65.4 mtt-85 -58.49 -48.89 79.31 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-N 118.583 0.628 . . . . 0.0 111.276 178.551 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -70.58 -32.88 70.43 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.341 -178.031 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.478 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 96.6 mt -76.93 -34.02 57.68 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 122.724 0.41 . . . . 0.0 111.943 176.328 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -67.01 -51.13 58.74 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.954 0.901 . . . . 0.0 108.815 179.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.6 ptp180 -62.78 -32.13 73.24 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.538 0.735 . . . . 0.0 110.302 -179.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -60.79 -46.64 89.72 Favored 'General case' 0 C--N 1.363 1.174 0 C-N-CA 123.656 0.782 . . . . 0.0 111.782 176.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.567 ' HB2' ' HA ' ' A' ' 58' ' ' LEU . 2.7 pp -96.85 -0.37 47.95 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -177.741 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 . . . . . 0 N--CA 1.486 1.353 0 C-N-CA 123.895 0.878 . . . . 0.0 109.993 172.479 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.567 ' HA ' ' HB2' ' A' ' 27' ' ' LEU . 6.4 mp . . . . . 0 CA--C 1.544 0.75 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -76.99 143.47 28.8 Favored Glycine 0 N--CA 1.471 0.988 0 CA-C-O 118.502 -1.165 . . . . 0.0 110.992 179.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -51.81 -52.56 48.23 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 124.348 1.059 . . . . 0.0 112.546 -171.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.456 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 7.5 p -53.6 -39.12 36.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 O-C-N 123.841 0.713 . . . . 0.0 111.761 177.124 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.423 ' O ' HD13 ' A' ' 66' ' ' LEU . . . -68.59 -43.28 77.41 Favored Glycine 0 C--N 1.345 1.069 0 O-C-N 123.616 0.573 . . . . 0.0 112.152 177.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -67.26 -41.57 85.32 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.637 0.775 . . . . 0.0 110.997 -175.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -74.74 -28.23 60.69 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 124.094 0.871 . . . . 0.0 111.239 179.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.456 ' HB2' ' O ' ' A' ' 61' ' ' VAL . 0.5 OUTLIER -71.73 -44.86 63.4 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 177.63 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.423 HD13 ' O ' ' A' ' 62' ' ' GLY . 5.8 mp -57.0 -47.83 79.9 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.759 1.224 . . . . 0.0 110.171 170.416 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -61.47 -37.21 82.78 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.132 0.973 . . . . 0.0 110.834 -176.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.67 -40.97 65.88 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.064 0.946 . . . . 0.0 111.021 177.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.642 HG21 ' HB3' ' A' ' 20' ' ' GLN . 83.3 mt -66.29 -53.33 37.65 Favored 'Isoleucine or valine' 0 C--N 1.356 0.857 0 C-N-CA 123.493 0.717 . . . . 0.0 110.804 -179.205 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -65.35 -27.28 68.47 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.943 0.897 . . . . 0.0 111.925 178.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.3 -37.02 77.59 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 122.686 0.394 . . . . 0.0 110.326 172.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.518 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -69.62 -41.71 75.32 Favored 'General case' 0 C--N 1.348 0.507 0 C-N-CA 123.368 0.667 . . . . 0.0 110.644 176.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.532 HD23 HD12 ' A' ' 76' ' ' ILE . 86.5 mt -68.02 -32.55 73.0 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.181 0.993 . . . . 0.0 110.923 179.137 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.5 -38.93 85.07 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.819 0.848 . . . . 0.0 110.383 173.047 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.43 ' HE ' ' HA ' ' A' ' 72' ' ' ALA . 87.1 mtm180 -67.69 -30.53 70.07 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.979 174.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.532 HD12 HD23 ' A' ' 73' ' ' LEU . 74.2 mt -70.84 -40.85 77.1 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 175.571 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.5 -32.46 72.49 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.896 0.878 . . . . 0.0 111.526 177.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.491 ' HB3' HG22 ' A' ' 80' ' ' THR . 34.2 t -88.08 -22.54 24.11 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.465 0.706 . . . . 0.0 111.154 176.453 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 85.31 9.77 78.9 Favored Glycine 0 C--N 1.346 1.116 0 CA-C-N 116.594 -0.275 . . . . 0.0 113.058 -175.552 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.491 HG22 ' HB3' ' A' ' 78' ' ' SER . 15.0 t -102.97 26.4 8.21 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.221 1.008 . . . . 0.0 109.612 179.302 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 90.9 t80 -63.93 147.74 51.23 Favored 'General case' 0 C--N 1.351 0.642 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 171.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 69.56 46.39 55.33 Favored Glycine 0 C--N 1.341 0.854 0 N-CA-C 110.737 -0.945 . . . . 0.0 110.737 -172.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 98.7 m -129.63 116.95 19.61 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.703 0.801 . . . . 0.0 110.167 174.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 42.9 t -68.52 100.26 1.08 Allowed 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 166.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 33.7 m -62.19 -27.4 42.48 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 123.995 0.918 . . . . 0.0 112.456 -176.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.488 ' HD2' ' HB3' ' A' ' 108' ' ' CYS . 24.5 ttmm -67.21 -33.69 75.9 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.496 0.718 . . . . 0.0 110.24 174.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 54.7 m -86.89 -29.18 22.34 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.632 0.773 . . . . 0.0 111.149 174.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 66.99 22.09 72.05 Favored Glycine 0 C--N 1.342 0.894 0 CA-C-N 115.79 -0.641 . . . . 0.0 112.392 -165.2 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -138.1 173.44 11.62 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.764 0.826 . . . . 0.0 110.684 -173.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 -64.89 151.47 45.54 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.943 1.297 . . . . 0.0 114.335 -170.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 13.7 mm -90.94 150.78 3.64 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.952 0 C-N-CA 125.537 1.535 . . . . 0.0 109.131 173.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 31.6 m -75.97 151.95 37.13 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 175.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -59.16 -41.62 88.79 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.202 0.601 . . . . 0.0 111.142 -179.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -61.7 -39.46 91.55 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.042 0.937 . . . . 0.0 111.217 -178.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.535 ' HE ' HG21 ' A' ' 102' ' ' THR . 29.7 tpt180 -64.74 -42.98 94.79 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.741 176.293 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 92.1 mt -67.98 -41.6 82.1 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.362 0.665 . . . . 0.0 112.209 -176.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -71.8 -28.3 63.51 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 122.587 0.355 . . . . 0.0 110.55 -178.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.22 -38.3 27.21 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.54 0.736 . . . . 0.0 110.884 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.4 p -160.76 95.55 1.45 Allowed Pre-proline 0 CA--C 1.559 1.291 0 C-N-CA 124.738 1.215 . . . . 0.0 109.501 -176.108 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . 0.511 ' HG2' HD21 ' A' ' 16' ' ' LEU . 69.2 Cg_endo -77.56 -23.28 9.97 Favored 'Trans proline' 0 C--N 1.375 1.972 0 C-N-CA 122.618 2.212 . . . . 0.0 113.539 -178.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 32.1 p90 -80.93 -9.3 59.85 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 -174.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.535 HG21 ' HE ' ' A' ' 95' ' ' ARG . 12.4 t -64.87 125.99 90.14 Favored Pre-proline 0 CA--C 1.565 1.527 0 CA-C-N 117.731 0.242 . . . . 0.0 111.187 -176.199 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -75.83 -12.93 19.89 Favored 'Trans proline' 0 C--N 1.375 1.931 0 C-N-CA 122.62 2.213 . . . . 0.0 112.627 174.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -121.68 157.11 31.6 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.608 0.763 . . . . 0.0 110.161 -176.268 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 29.3 p -86.02 165.21 16.86 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 175.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -46.39 -44.16 16.89 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 124.886 1.274 . . . . 0.0 114.35 -160.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.04 -26.86 28.76 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 122.215 -0.303 . . . . 0.0 110.787 -176.286 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.488 ' HB3' ' HD2' ' A' ' 86' ' ' LYS . 95.7 m -69.86 -26.45 64.21 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.961 0.904 . . . . 0.0 110.473 174.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -75.45 -36.23 60.74 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.851 0.86 . . . . 0.0 110.048 172.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -78.13 -8.86 58.8 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.942 173.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.056 0 C-N-CA 123.647 0.779 . . . . 0.0 111.117 174.763 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 11.5 m120 . . . . . 0 N--CA 1.494 1.754 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.5 t -50.98 -46.83 30.64 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 C-N-CA 123.571 0.748 . . . . 0.0 112.088 175.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -65.56 -36.01 82.53 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.515 0.726 . . . . 0.0 111.681 -176.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.0 m -67.11 -37.97 84.82 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.256 176.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -70.23 -35.5 73.88 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.272 176.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.1 tm-20 -60.71 -57.63 11.87 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.984 0.913 . . . . 0.0 109.381 -176.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.436 ' HG3' ' N ' ' A' ' 15' ' ' ILE . 12.8 ptmt -63.82 -42.11 97.73 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.592 -176.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.436 ' N ' ' HG3' ' A' ' 14' ' ' LYS . 15.2 tt -68.78 -29.48 43.72 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 -175.061 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.524 ' HB3' HG23 ' A' ' 69' ' ' ILE . 70.7 mt -74.01 -35.48 64.39 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.241 0.616 . . . . 0.0 110.779 174.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.445 ' NH2' HD13 ' A' ' 73' ' ' LEU . 1.7 mmp_? -59.98 -49.28 78.29 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 172.356 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 49.2 m-20 -64.12 -41.64 97.15 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 124.006 0.922 . . . . 0.0 110.943 -177.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -66.87 -46.02 76.29 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.68 -178.626 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.592 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.8 pt20 -67.45 -29.25 68.67 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-O 118.871 -0.585 . . . . 0.0 110.099 -179.394 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.402 ' HG2' ' O ' ' A' ' 17' ' ' ARG . 33.3 mmt180 -70.22 -46.86 63.64 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.708 0.803 . . . . 0.0 111.867 -179.301 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -68.43 -32.7 72.92 Favored 'General case' 0 N--CA 1.48 1.067 0 O-C-N 123.238 0.336 . . . . 0.0 110.542 178.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 97.1 mt -74.54 -33.29 62.7 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.021 174.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -58.89 -59.66 5.09 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 38.3 ptt180 -59.01 -37.57 77.21 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 123.719 0.637 . . . . 0.0 111.28 -178.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 75.5 ttt180 -57.42 -56.11 26.15 Favored 'General case' 0 C--N 1.356 0.874 0 C-N-CA 124.119 0.968 . . . . 0.0 112.046 178.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.426 ' O ' ' HA ' ' A' ' 58' ' ' LEU . 4.5 pp -87.85 -22.55 24.39 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -172.536 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 . . . . . 0 N--CA 1.481 1.116 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 175.752 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.426 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 68.5 mt . . . . . 0 CA--C 1.546 0.793 0 N-CA-C 110.413 -0.217 . . . . 0.0 110.413 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 127.0 114.51 1.88 Allowed Glycine 0 N--CA 1.472 1.035 0 N-CA-C 110.819 -0.913 . . . . 0.0 110.819 -176.392 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -49.93 -52.62 31.93 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.273 1.429 . . . . 0.0 113.37 -170.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 7.4 p -53.08 -42.56 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 123.234 0.614 . . . . 0.0 112.205 -178.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -74.74 -32.83 56.73 Favored Glycine 0 C--N 1.344 1.011 0 CA-C-N 115.538 -0.756 . . . . 0.0 112.113 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -68.34 -45.76 71.99 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.626 0.77 . . . . 0.0 111.43 -179.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -64.76 -36.75 85.32 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.542 0.737 . . . . 0.0 109.662 176.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.31 -48.56 75.18 Favored 'General case' 0 C--N 1.354 0.789 0 O-C-N 124.122 0.889 . . . . 0.0 110.467 177.416 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.4 mp -57.38 -46.62 83.2 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.175 0.99 . . . . 0.0 110.635 177.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 77.2 ttt180 -62.24 -37.1 84.11 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.508 -178.1 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.454 ' HB1' ' O ' ' A' ' 101' ' ' TYR . . . -74.53 -39.33 62.43 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 123.995 0.918 . . . . 0.0 111.542 179.201 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.592 HG21 ' HB3' ' A' ' 20' ' ' GLN . 85.3 mt -73.06 -54.92 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 123.785 0.834 . . . . 0.0 110.39 -176.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -59.67 -30.18 68.58 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.05 0.94 . . . . 0.0 111.789 176.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.476 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -64.11 -52.68 57.99 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 123.429 0.456 . . . . 0.0 110.319 172.094 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.466 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -61.2 -40.41 93.84 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.929 0.892 . . . . 0.0 111.496 -178.138 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.519 HD23 HD12 ' A' ' 76' ' ' ILE . 66.1 mt -67.84 -37.1 81.46 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.711 1.205 . . . . 0.0 111.505 178.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.61 -33.04 75.01 Favored 'General case' 0 N--CA 1.478 0.951 0 O-C-N 123.615 0.572 . . . . 0.0 110.296 173.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.476 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 79.7 mtt-85 -79.99 -25.91 40.12 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.274 0.629 . . . . 0.0 111.466 178.288 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.519 HD12 HD23 ' A' ' 73' ' ' LEU . 98.1 mt -71.33 -49.9 44.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 175.708 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.19 -28.09 68.49 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.606 0.762 . . . . 0.0 111.106 178.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 30.5 t -75.56 -34.22 60.7 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.43 0.692 . . . . 0.0 110.627 172.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 90.78 7.94 65.88 Favored Glycine 0 CA--C 1.53 0.989 0 CA-C-N 115.759 -0.655 . . . . 0.0 113.158 -176.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 14.0 t -97.44 10.35 39.95 Favored 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 123.669 0.788 . . . . 0.0 110.481 178.019 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -64.93 136.55 56.95 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.082 0.553 . . . . 0.0 109.914 171.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.15 13.14 64.51 Favored Glycine 0 CA--C 1.527 0.803 0 O-C-N 123.619 0.575 . . . . 0.0 111.89 -169.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 89.4 m -125.68 119.67 28.63 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 123.741 0.816 . . . . 0.0 109.753 175.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . 0.469 ' HB2' HD13 ' A' ' 91' ' ' ILE . 49.6 t -77.06 91.89 3.7 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 124.072 0.949 . . . . 0.0 109.743 170.635 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 25.3 m -64.35 -20.02 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 124.016 0.927 . . . . 0.0 112.152 -178.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 49.8 tttm -66.41 -22.8 66.24 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.928 0.891 . . . . 0.0 111.874 -179.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.428 ' SG ' ' HB2' ' A' ' 89' ' ' LYS . 31.7 p -137.85 10.07 2.85 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 122.635 0.374 . . . . 0.0 111.488 177.014 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 63.85 20.21 64.07 Favored Glycine 0 C--N 1.358 1.76 0 N-CA-C 114.185 0.434 . . . . 0.0 114.185 179.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.428 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 31.6 mmmt -106.92 -173.77 2.37 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.094 0.958 . . . . 0.0 110.62 -176.487 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 13.1 mmm180 -83.54 163.84 20.18 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 124.454 1.102 . . . . 0.0 112.139 176.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.469 HD13 ' HB2' ' A' ' 84' ' ' CYS . 5.7 mm -101.21 143.43 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 N-CA-C 106.416 -1.698 . . . . 0.0 106.416 159.361 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.6 m -70.9 140.82 51.13 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 173.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -61.06 -35.86 78.08 Favored 'General case' 0 N--CA 1.483 1.185 0 CA-C-N 117.95 0.341 . . . . 0.0 110.124 174.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -58.29 -40.92 83.23 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.187 0.995 . . . . 0.0 110.34 175.337 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.531 ' HD2' ' HB2' ' A' ' 106' ' ' GLN . 0.2 OUTLIER -68.71 -40.19 80.08 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.699 176.947 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 94.6 mt -69.01 -34.81 75.87 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.844 0.858 . . . . 0.0 112.307 -176.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 15.5 ptpt -80.73 -27.08 36.99 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 122.627 0.371 . . . . 0.0 110.215 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -79.31 -29.36 42.34 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.643 0.777 . . . . 0.0 110.999 175.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.422 ' O ' HG22 ' A' ' 102' ' ' THR . 2.3 p -165.84 99.9 0.74 Allowed Pre-proline 0 CA--C 1.557 1.244 0 C-N-CA 124.828 1.251 . . . . 0.0 108.909 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . 0.423 ' HG2' HD21 ' A' ' 16' ' ' LEU . 79.2 Cg_endo -78.21 -12.93 15.65 Favored 'Trans proline' 0 C--N 1.373 1.845 0 C-N-CA 122.65 2.233 . . . . 0.0 113.681 179.113 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . 0.454 ' O ' ' HB1' ' A' ' 68' ' ' ALA . 24.0 p90 -94.66 22.02 6.73 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 122.601 0.361 . . . . 0.0 111.932 -179.211 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.422 HG22 ' O ' ' A' ' 99' ' ' VAL . 14.1 t -97.51 112.48 61.35 Favored Pre-proline 0 CA--C 1.56 1.358 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 172.526 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -78.39 -4.44 14.22 Favored 'Trans proline' 0 C--N 1.376 1.977 0 C-N-CA 122.635 2.224 . . . . 0.0 112.009 171.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -114.75 146.15 41.29 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.957 0.903 . . . . 0.0 109.975 -176.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 26.0 p -75.67 160.72 29.77 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 175.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.531 ' HB2' ' HD2' ' A' ' 95' ' ' ARG . 52.0 tp60 -56.61 -29.95 62.73 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 118.387 0.539 . . . . 0.0 111.779 -175.312 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -61.57 -49.75 75.41 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 124.826 1.25 . . . . 0.0 109.844 177.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 98.3 m -70.3 -36.29 74.25 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.346 0.658 . . . . 0.0 111.662 177.047 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -61.38 -33.97 74.55 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.782 0.833 . . . . 0.0 110.968 179.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -82.6 -28.91 30.52 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.819 0.847 . . . . 0.0 111.152 175.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.265 0 C-N-CA 124.065 0.946 . . . . 0.0 112.61 -174.418 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 52.5 t30 . . . . . 0 N--CA 1.483 1.217 0 CA-C-O 121.369 0.604 . . . . 0.0 112.026 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.8 t -71.57 -26.43 26.24 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.034 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.199 -179.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -58.53 -42.21 87.26 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 123.207 0.603 . . . . 0.0 112.544 -174.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 33.2 m -59.73 -41.86 91.83 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 121.352 0.596 . . . . 0.0 110.833 178.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -71.34 -38.39 71.66 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-N 114.942 -1.026 . . . . 0.0 110.487 179.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.469 ' O ' ' HG3' ' A' ' 17' ' ' ARG . 3.0 tm-20 -57.9 -54.95 41.09 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.507 1.123 . . . . 0.0 110.127 -177.546 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.56 -41.59 88.4 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.171 -176.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 14.9 tt -68.22 -29.94 46.14 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 N-CA-C 110.329 -0.249 . . . . 0.0 110.329 -177.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.541 ' HB3' HG23 ' A' ' 69' ' ' ILE . 77.5 mt -73.35 -33.19 64.96 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.673 0.789 . . . . 0.0 111.168 176.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.469 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 25.7 mtm180 -64.51 -37.51 87.78 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 175.274 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -82.52 -24.68 33.98 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.002 0.521 . . . . 0.0 110.522 -178.536 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.428 ' HD2' ' HA ' ' A' ' 19' ' ' ARG . 18.4 tpt180 -73.45 -43.45 60.29 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.505 179.347 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.576 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.7 pt20 -73.45 -29.46 62.56 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 119.005 -0.521 . . . . 0.0 110.018 176.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 91.8 mtt180 -55.29 -58.29 8.32 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 172.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.4 ' HA ' ' HE ' ' A' ' 25' ' ' ARG . 11.7 pt-20 -63.78 -38.24 90.37 Favored 'General case' 0 C--N 1.352 0.686 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.098 -175.166 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.712 HD23 HH11 ' A' ' 26' ' ' ARG . 89.4 mt -65.34 -52.24 55.12 Favored 'General case' 0 C--O 1.216 -0.688 0 O-C-N 123.877 0.735 . . . . 0.0 110.956 177.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -48.0 -53.49 16.03 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 124.303 1.041 . . . . 0.0 111.25 -178.575 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.4 ' HE ' ' HA ' ' A' ' 22' ' ' GLU . 29.8 ptt180 -74.88 -26.19 59.49 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -178.713 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.712 HH11 HD23 ' A' ' 23' ' ' LEU . 39.5 ttm180 -66.58 -48.94 67.97 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.832 0.853 . . . . 0.0 111.124 175.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.553 HD21 HD22 ' A' ' 66' ' ' LEU . 4.1 pp -80.38 -24.69 39.59 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.31 0.644 . . . . 0.0 110.679 -178.192 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 52.6 m170 . . . . . 0 N--CA 1.483 1.179 0 C-N-CA 123.171 0.589 . . . . 0.0 111.21 171.927 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.478 HD13 HD13 ' A' ' 27' ' ' LEU . 31.8 mt . . . . . 0 N--CA 1.471 0.597 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -58.68 130.12 50.58 Favored Glycine 0 CA--C 1.534 1.242 0 CA-C-O 119.207 -0.774 . . . . 0.0 112.197 176.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -67.15 -42.21 84.75 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.304 0.642 . . . . 0.0 112.313 -171.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 7.3 p -59.9 -32.09 49.07 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 C-N-CA 122.926 0.491 . . . . 0.0 109.74 173.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.529 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -64.86 -56.69 15.01 Favored Glycine 0 C--O 1.214 -1.104 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.615 174.586 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.445 ' NE2' ' HB2' ' A' ' 58' ' ' LEU . 98.0 mt-30 -58.9 -43.77 91.07 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 125.173 1.389 . . . . 0.0 111.946 -176.631 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -67.28 -49.11 65.57 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.125 -175.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -70.02 -28.9 65.87 Favored 'General case' 0 C--O 1.217 -0.614 0 CA-C-N 114.649 -1.16 . . . . 0.0 110.24 179.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.553 HD22 HD21 ' A' ' 27' ' ' LEU . 11.1 tp -64.24 -44.79 90.74 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.358 1.063 . . . . 0.0 109.551 178.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 65.2 ttt180 -74.95 -29.48 60.94 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 114.736 -1.12 . . . . 0.0 110.507 -179.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.57 -41.34 88.72 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.423 0.689 . . . . 0.0 110.247 174.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.576 HG21 ' HB3' ' A' ' 20' ' ' GLN . 95.5 mt -70.56 -37.76 71.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.887 0.875 . . . . 0.0 109.875 175.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -63.24 -36.43 83.62 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.272 0.629 . . . . 0.0 110.268 176.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -75.88 -34.08 59.98 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.906 0.882 . . . . 0.0 111.113 177.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.473 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -69.92 -53.88 15.88 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.441 0.696 . . . . 0.0 110.73 -179.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.583 HD23 HD12 ' A' ' 76' ' ' ILE . 95.5 mt -61.78 -31.94 72.19 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.455 1.102 . . . . 0.0 111.249 176.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.53 -49.69 76.54 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 123.615 0.572 . . . . 0.0 110.175 172.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.464 ' HE ' ' HA ' ' A' ' 72' ' ' ALA . 86.8 mtm180 -63.56 -30.9 71.95 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 124.043 0.839 . . . . 0.0 111.844 178.427 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.583 HD12 HD23 ' A' ' 73' ' ' LEU . 66.4 mt -69.24 -43.42 81.37 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 177.019 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.62 -25.23 64.74 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.941 176.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 69.8 m -91.61 -7.55 49.78 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.413 1.085 . . . . 0.0 112.344 178.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 69.33 23.46 76.36 Favored Glycine 0 C--N 1.35 1.325 0 N-CA-C 113.77 0.268 . . . . 0.0 113.77 178.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 9.9 t -129.85 29.34 5.0 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 124.589 1.156 . . . . 0.0 110.449 -179.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -63.97 148.66 49.07 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 121.938 -0.476 . . . . 0.0 110.271 171.573 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.462 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 70.09 37.72 73.07 Favored Glycine 0 C--N 1.342 0.866 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.611 -175.267 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 90.8 m -129.45 124.06 33.13 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.588 0.755 . . . . 0.0 109.448 175.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . 0.421 ' HB3' ' HB2' ' A' ' 87' ' ' CYS . 37.5 t -67.85 108.37 2.97 Favored 'General case' 0 C--N 1.35 0.622 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 169.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 29.2 m -62.34 -28.47 44.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 O-C-N 124.134 0.896 . . . . 0.0 111.167 176.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 38.3 tttm -81.11 -8.04 59.68 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.518 1.127 . . . . 0.0 111.673 -177.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.529 ' HB3' ' HG2' ' A' ' 89' ' ' LYS . 60.8 m -122.07 -24.1 5.22 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.895 0.878 . . . . 0.0 111.696 176.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 62.77 46.58 93.35 Favored Glycine 0 CA--C 1.537 1.425 0 O-C-N 123.508 0.505 . . . . 0.0 113.178 -168.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.529 ' HG2' ' HB3' ' A' ' 87' ' ' CYS . 0.0 OUTLIER -159.88 171.17 19.91 Favored 'General case' 0 N--CA 1.498 1.945 0 N-CA-C 112.616 0.598 . . . . 0.0 112.616 -179.103 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.462 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 13.9 tpp180 -64.4 144.11 57.41 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 125.377 1.471 . . . . 0.0 113.192 -172.462 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 26.1 mm -91.73 149.7 4.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 125.179 1.392 . . . . 0.0 108.847 172.069 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 24.8 m -67.58 140.59 56.94 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 174.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -59.21 -36.54 75.59 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 122.869 0.468 . . . . 0.0 111.209 -178.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -63.96 -36.05 82.68 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.658 0.783 . . . . 0.0 111.267 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.523 ' HD2' ' HB2' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -65.57 -40.71 93.09 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.221 175.45 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 95.2 mt -75.07 -31.74 61.31 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -176.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.2 ptpt -76.03 -28.17 57.61 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 109.827 -0.435 . . . . 0.0 109.827 178.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -83.48 -35.24 25.05 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.671 0.788 . . . . 0.0 111.316 176.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.4 p -158.53 91.9 2.06 Favored Pre-proline 0 CA--C 1.557 1.237 0 C-N-CA 124.536 1.134 . . . . 0.0 109.055 -177.162 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . 0.527 ' HG2' HD21 ' A' ' 16' ' ' LEU . 58.8 Cg_endo -74.06 -28.27 11.12 Favored 'Trans proline' 0 C--N 1.377 2.069 0 C-N-CA 122.639 2.226 . . . . 0.0 113.324 -178.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . 0.458 ' HA ' ' HB2' ' A' ' 72' ' ' ALA . 29.6 p90 -77.96 -2.55 37.51 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -173.407 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.1 t -65.62 116.77 34.82 Favored Pre-proline 0 CA--C 1.563 1.457 0 CA-C-N 117.862 0.301 . . . . 0.0 110.72 -179.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -73.45 -16.51 24.38 Favored 'Trans proline' 0 C--N 1.381 2.259 0 C-N-CA 122.489 2.126 . . . . 0.0 111.474 175.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.489 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 12.7 m-85 -113.11 174.83 5.71 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.421 1.088 . . . . 0.0 110.279 -176.262 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 31.1 p -98.19 173.97 6.75 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.193 0.597 . . . . 0.0 109.812 175.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.523 ' HB2' ' HD2' ' A' ' 95' ' ' ARG . 6.6 tp60 -56.66 -38.94 72.89 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.443 0.697 . . . . 0.0 112.325 -177.042 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -64.24 -48.51 75.52 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.169 0.588 . . . . 0.0 111.404 179.186 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.489 ' HB2' ' HB3' ' A' ' 104' ' ' PHE . 97.0 m -64.85 -36.17 83.47 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.044 0.538 . . . . 0.0 110.91 176.442 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.58 -35.25 78.65 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.824 0.849 . . . . 0.0 110.68 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -77.09 -25.37 52.21 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.784 175.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.87 0 C-N-CA 123.743 0.817 . . . . 0.0 112.098 -179.866 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 . . . . . 0 N--CA 1.485 1.322 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.433 ' O ' ' HB2' ' A' ' 13' ' ' GLU . 88.6 t -60.93 -28.6 43.81 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 CA-C-O 119.064 -0.493 . . . . 0.0 111.826 -176.222 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -59.5 -49.17 78.81 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 174.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.9 m -58.43 -42.45 87.31 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.891 0.876 . . . . 0.0 110.755 179.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -73.16 -32.45 64.87 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.112 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 9' ' ' VAL . 3.3 tm-20 -63.99 -54.19 38.26 Favored 'General case' 0 C--O 1.243 0.728 0 C-N-CA 124.535 1.134 . . . . 0.0 109.984 -177.019 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.6 -45.0 80.61 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 114.396 -1.275 . . . . 0.0 111.406 -177.254 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 10.8 tt -64.77 -33.4 63.14 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 CA-C-N 118.08 0.4 . . . . 0.0 110.713 -175.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.575 ' HB3' HG23 ' A' ' 69' ' ' ILE . 37.5 mt -65.77 -45.29 83.07 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.348 0.659 . . . . 0.0 111.127 175.497 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.508 ' O ' ' HG3' ' A' ' 21' ' ' ARG . 52.1 mtm180 -62.81 -46.47 87.81 Favored 'General case' 0 C--O 1.214 -0.783 0 O-C-N 123.647 0.592 . . . . 0.0 110.986 177.691 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -56.75 -46.97 81.08 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.686 0.795 . . . . 0.0 111.268 176.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? -66.24 -33.11 75.01 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.269 179.186 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.668 ' HB3' HG21 ' A' ' 69' ' ' ILE . 1.3 pt20 -81.78 -22.14 37.35 Favored 'General case' 0 C--O 1.21 -0.985 0 CA-C-O 118.805 -0.617 . . . . 0.0 110.486 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.508 ' HG3' ' O ' ' A' ' 17' ' ' ARG . 82.4 mtt180 -65.08 -49.21 70.91 Favored 'General case' 0 N--CA 1.484 1.273 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 175.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -65.76 -37.54 86.62 Favored 'General case' 0 C--N 1.355 0.84 0 O-C-N 123.962 0.789 . . . . 0.0 110.676 179.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 71.9 mt -69.21 -41.03 77.62 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 122.803 0.441 . . . . 0.0 111.704 177.264 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -63.16 -53.47 52.81 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.369 0.668 . . . . 0.0 109.817 -177.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -66.45 -26.65 67.3 Favored 'General case' 0 N--CA 1.484 1.263 0 O-C-N 123.204 0.315 . . . . 0.0 111.689 178.221 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 17.4 ttm-85 -65.13 -47.97 75.25 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.536 0.734 . . . . 0.0 111.462 176.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.627 HD21 HD22 ' A' ' 66' ' ' LEU . 4.0 pp -82.19 -30.18 31.07 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-O 120.64 0.257 . . . . 0.0 110.557 -178.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 87.8 m-70 . . . . . 0 N--CA 1.481 1.104 0 C-N-CA 123.576 0.75 . . . . 0.0 110.958 174.875 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.437 HD13 HD13 ' A' ' 27' ' ' LEU . 11.1 mt . . . . . 0 CA--C 1.543 0.674 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -86.83 135.77 13.5 Favored Glycine 0 N--CA 1.467 0.723 0 CA-C-O 119.153 -0.804 . . . . 0.0 111.1 173.184 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -56.89 -51.7 68.05 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.441 1.097 . . . . 0.0 111.811 -176.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.5 t -65.34 -33.87 66.62 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 124.133 0.973 . . . . 0.0 110.117 178.212 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.614 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -64.43 -39.96 97.35 Favored Glycine 0 C--O 1.217 -0.927 0 O-C-N 123.487 0.492 . . . . 0.0 111.94 177.474 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -75.66 -38.37 58.84 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.373 1.069 . . . . 0.0 111.484 -178.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -80.75 -36.58 31.77 Favored 'General case' 0 N--CA 1.485 1.316 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.094 -173.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -69.85 -36.08 75.24 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 173.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.627 HD22 HD21 ' A' ' 27' ' ' LEU . 9.5 tp -57.86 -47.57 82.35 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.168 0.987 . . . . 0.0 109.839 171.796 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 38.8 ttt180 -56.92 -44.17 82.17 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.864 1.265 . . . . 0.0 111.193 177.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.8 -38.19 88.3 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.579 0.752 . . . . 0.0 110.749 179.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.668 HG21 ' HB3' ' A' ' 20' ' ' GLN . 74.6 mt -65.78 -50.65 69.37 Favored 'Isoleucine or valine' 0 C--N 1.351 0.647 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.332 177.217 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -68.92 -28.75 66.95 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.176 0.991 . . . . 0.0 111.617 -176.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.32 -44.91 77.99 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.469 0.707 . . . . 0.0 109.621 175.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.5 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -64.48 -45.78 85.86 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 114.76 -1.109 . . . . 0.0 110.633 177.257 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.624 HD23 HD12 ' A' ' 76' ' ' ILE . 92.6 mt -64.16 -34.28 77.7 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 124.479 1.112 . . . . 0.0 111.636 179.041 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.59 -42.17 98.47 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 123.985 0.803 . . . . 0.0 109.947 176.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 58.3 mtp85 -74.72 -25.43 59.12 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 114.804 -1.089 . . . . 0.0 111.881 178.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.624 HD12 HD23 ' A' ' 73' ' ' LEU . 47.6 mt -67.82 -44.93 85.15 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 CA-C-N 118.662 0.664 . . . . 0.0 109.957 175.077 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.34 -39.21 89.74 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 124.085 0.866 . . . . 0.0 110.379 174.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 27.5 t -78.3 -10.72 59.79 Favored 'General case' 0 CA--C 1.555 1.164 0 CA-C-N 115.074 -0.966 . . . . 0.0 111.725 179.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 77.0 10.22 86.37 Favored Glycine 0 C--N 1.351 1.411 0 N-CA-C 113.765 0.266 . . . . 0.0 113.765 178.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 7.5 t -117.87 27.98 8.69 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 124.724 1.21 . . . . 0.0 111.08 -179.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.457 ' HE1' ' HB1' ' A' ' 72' ' ' ALA . 80.1 t80 -53.43 149.14 8.01 Favored 'General case' 0 N--CA 1.485 1.313 0 O-C-N 121.901 -0.499 . . . . 0.0 111.867 170.58 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.54 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 69.52 41.83 75.05 Favored Glycine 0 C--O 1.212 -1.253 0 CA-C-N 114.619 -1.173 . . . . 0.0 111.149 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 31.5 m -124.82 108.75 12.26 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-O 121.265 0.555 . . . . 0.0 109.629 176.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 51.4 t -62.52 98.6 0.12 Allowed 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 114.366 -1.288 . . . . 0.0 110.659 172.085 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 27.5 m -63.65 -23.71 34.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 O-C-N 124.381 1.05 . . . . 0.0 112.374 -175.019 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.494 ' HD3' ' HB3' ' A' ' 108' ' ' CYS . 47.0 tttm -67.76 -26.32 66.06 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.453 0.701 . . . . 0.0 112.046 -177.281 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 31.9 p -133.52 4.25 3.64 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 122.614 0.366 . . . . 0.0 111.648 179.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 61.08 28.42 68.9 Favored Glycine 0 C--N 1.351 1.395 0 N-CA-C 114.483 0.553 . . . . 0.0 114.483 -179.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 46.9 mtmt -116.38 166.27 12.26 Favored 'General case' 0 N--CA 1.487 1.404 0 CA-C-N 117.238 0.519 . . . . 0.0 110.67 -177.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.54 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 7.2 tpp180 -67.21 146.63 54.0 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 124.517 1.127 . . . . 0.0 111.116 177.078 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 10.5 mm -85.77 144.27 9.87 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 170.155 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 5.4 m -67.94 142.19 56.09 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 109.049 -0.722 . . . . 0.0 109.049 176.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -62.29 -29.14 70.22 Favored 'General case' 0 N--CA 1.484 1.272 0 CA-C-N 118.294 0.497 . . . . 0.0 109.976 174.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -57.0 -52.96 63.17 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.534 1.134 . . . . 0.0 111.248 169.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.57 -35.51 80.75 Favored 'General case' 0 C--O 1.214 -0.809 0 O-C-N 124.296 0.997 . . . . 0.0 110.011 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 89.4 mt -72.69 -40.39 66.26 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.467 0.707 . . . . 0.0 111.841 -179.288 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.411 ' HZ3' ' HB3' ' A' ' 97' ' ' LYS . 0.3 OUTLIER -75.01 -28.29 60.46 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.362 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.32 -43.5 50.5 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.973 0.909 . . . . 0.0 110.842 173.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.3 p -151.85 99.73 2.92 Favored Pre-proline 0 CA--C 1.554 1.098 0 C-N-CA 124.6 1.16 . . . . 0.0 108.876 -177.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -66.65 -24.87 47.5 Favored 'Trans proline' 0 C--N 1.373 1.86 0 C-N-CA 122.789 2.326 . . . . 0.0 113.434 179.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 28.4 p90 -93.36 54.63 2.11 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.134 0.974 . . . . 0.0 110.677 -178.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 4.1 t -112.76 103.52 55.61 Favored Pre-proline 0 CA--C 1.554 1.1 0 C-N-CA 123.434 0.694 . . . . 0.0 110.696 -179.066 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -76.26 -9.48 19.02 Favored 'Trans proline' 0 C--N 1.376 1.976 0 C-N-CA 122.852 2.368 . . . . 0.0 112.215 168.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -127.08 117.17 21.9 Favored 'General case' 0 C--N 1.359 1.005 0 C-N-CA 123.501 0.721 . . . . 0.0 110.31 -174.085 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 16.7 p -64.09 159.22 20.81 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 118.145 -0.931 . . . . 0.0 109.28 175.181 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -44.91 -39.38 5.39 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 124.313 1.045 . . . . 0.0 113.493 -169.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -58.09 -53.79 54.22 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.155 0.982 . . . . 0.0 111.217 176.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.494 ' HB3' ' HD3' ' A' ' 86' ' ' LYS . 85.0 m -73.4 -31.88 64.13 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 114.759 -1.109 . . . . 0.0 111.754 -176.376 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.9 -38.91 92.55 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.127 0.971 . . . . 0.0 110.507 176.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.75 -30.19 62.65 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.489 0.716 . . . . 0.0 110.876 174.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.928 0 C-N-CA 123.822 0.849 . . . . 0.0 112.453 -179.509 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 . . . . . 0 C--O 1.241 0.651 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 60.5 t -67.72 -33.94 64.8 Favored 'Isoleucine or valine' 0 C--N 1.347 0.482 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.225 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -65.34 -30.22 71.04 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 123.836 0.71 . . . . 0.0 111.697 179.003 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 47.5 m -65.88 -44.23 85.94 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 122.708 0.403 . . . . 0.0 110.061 173.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -67.95 -35.19 77.98 Favored 'General case' 0 C--O 1.217 -0.634 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.51 176.219 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.9 tm-20 -63.59 -55.31 24.77 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.299 1.039 . . . . 0.0 109.41 -176.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.422 ' HB2' ' HE3' ' A' ' 14' ' ' LYS . 15.4 ptmt -71.03 -35.46 71.99 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.252 -173.562 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.501 ' O ' ' HB2' ' A' ' 19' ' ' ARG . 12.3 tt -65.87 -33.95 67.02 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.551 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.55 ' HB3' HG23 ' A' ' 69' ' ' ILE . 69.6 mt -75.58 -34.05 60.64 Favored 'General case' 0 C--N 1.355 0.824 0 C-N-CA 123.952 0.901 . . . . 0.0 111.587 176.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.449 ' NH2' HD13 ' A' ' 73' ' ' LEU . 3.6 mmp_? -58.15 -49.91 75.35 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.097 0.559 . . . . 0.0 109.803 174.665 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -74.95 -27.93 60.38 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.02 0.528 . . . . 0.0 111.381 -179.01 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.501 ' HB2' ' O ' ' A' ' 15' ' ' ILE . 2.3 tpt180 -71.3 -41.98 69.26 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 123.622 0.577 . . . . 0.0 110.101 -178.217 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.621 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.5 pt20 -72.22 -30.35 64.83 Favored 'General case' 0 C--O 1.206 -1.22 0 CA-C-O 118.834 -0.603 . . . . 0.0 109.665 177.094 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.551 ' HB3' HH21 ' A' ' 25' ' ' ARG . 60.7 mtm-85 -68.43 -46.37 70.06 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.019 0.528 . . . . 0.0 111.999 179.66 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -63.58 -38.24 90.38 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 123.463 0.477 . . . . 0.0 110.428 177.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.565 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 81.5 mt -64.66 -48.77 73.57 Favored 'General case' 0 C--O 1.21 -0.981 0 O-C-N 123.495 0.497 . . . . 0.0 109.927 173.141 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.502 ' CE1' HD21 ' A' ' 66' ' ' LEU . 1.7 m-85 -57.41 -46.38 83.55 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.083 0.953 . . . . 0.0 110.871 -174.196 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.551 HH21 ' HB3' ' A' ' 21' ' ' ARG . 11.0 ptp180 -71.94 -28.11 63.24 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 122.747 0.419 . . . . 0.0 111.321 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 38.8 ttm180 -68.39 -56.52 8.21 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.435 0.694 . . . . 0.0 111.265 175.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 3.5 pp -80.88 -25.93 37.25 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.386 0.674 . . . . 0.0 111.51 -171.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.464 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 75.6 m-70 . . . . . 0 N--CA 1.483 1.189 0 C-N-CA 122.866 0.466 . . . . 0.0 110.109 169.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.475 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 50.0 mt . . . . . 0 CA--C 1.55 0.959 0 N-CA-C 110.516 -0.179 . . . . 0.0 110.516 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 151.07 139.75 3.05 Favored Glycine 0 C--N 1.346 1.1 0 CA-C-O 119.711 -0.494 . . . . 0.0 111.889 -178.532 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -57.2 -63.89 1.07 Allowed 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.774 1.23 . . . . 0.0 113.18 -170.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 60.4 t -59.82 -33.81 53.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 C-N-CA 124.39 1.076 . . . . 0.0 110.759 -177.294 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.536 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -63.68 -54.96 27.81 Favored Glycine 0 C--O 1.215 -1.082 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.766 177.232 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -67.87 -37.42 81.79 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 124.363 1.065 . . . . 0.0 112.092 -174.058 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -67.81 -46.07 72.96 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 123.901 0.75 . . . . 0.0 110.472 -179.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -70.17 -35.08 73.74 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.1 178.003 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.536 ' HB2' ' O ' ' A' ' 62' ' ' GLY . 11.9 tp -60.3 -46.3 90.36 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 124.943 1.297 . . . . 0.0 110.459 -179.306 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -66.64 -39.74 88.41 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 124.632 1.207 . . . . 0.0 110.674 178.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.415 ' HB1' ' O ' ' A' ' 101' ' ' TYR . . . -64.03 -39.99 95.32 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.673 0.789 . . . . 0.0 110.849 179.282 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.621 HG21 ' HB3' ' A' ' 20' ' ' GLN . 89.4 mt -66.87 -46.03 86.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-N 114.841 -1.072 . . . . 0.0 109.745 176.361 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -65.03 -33.12 75.28 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.063 0.945 . . . . 0.0 111.271 -177.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.58 -44.07 75.18 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.626 0.77 . . . . 0.0 110.275 178.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.426 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -63.45 -49.97 71.56 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.893 178.573 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.453 HD23 HD12 ' A' ' 76' ' ' ILE . 69.1 mt -61.23 -38.24 85.93 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.805 1.242 . . . . 0.0 112.246 179.038 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.55 -42.54 98.99 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.423 0.689 . . . . 0.0 110.485 177.338 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 86.8 mtt-85 -75.24 -21.85 58.29 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 114.761 -1.109 . . . . 0.0 112.369 -178.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.453 HD12 HD23 ' A' ' 73' ' ' LEU . 89.6 mt -67.24 -47.82 80.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 171.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -67.2 -30.64 70.64 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.362 178.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 29.1 t -80.48 -23.6 40.06 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.652 0.781 . . . . 0.0 111.113 177.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 87.99 7.29 74.29 Favored Glycine 0 C--N 1.35 1.333 0 C-N-CA 123.039 0.352 . . . . 0.0 113.657 -178.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.3 t -113.12 29.03 8.31 Favored 'General case' 0 CA--C 1.556 1.2 0 C-N-CA 124.082 0.953 . . . . 0.0 110.413 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -64.22 146.12 54.83 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 122.729 0.412 . . . . 0.0 110.413 169.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.503 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 74.36 31.32 59.28 Favored Glycine 0 C--N 1.341 0.842 0 O-C-N 123.82 0.7 . . . . 0.0 112.298 -177.748 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 26.6 m -117.89 110.85 18.25 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 122.887 0.475 . . . . 0.0 110.215 176.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . 0.453 ' HB2' HD13 ' A' ' 91' ' ' ILE . 44.0 t -77.57 95.64 4.59 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.154 0.981 . . . . 0.0 110.101 174.728 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 30.9 m -62.56 -30.77 49.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 O-C-N 124.138 0.898 . . . . 0.0 113.077 -175.44 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.536 ' HD2' ' HB3' ' A' ' 108' ' ' CYS . 22.7 ttmm -60.56 -32.19 71.28 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.439 0.696 . . . . 0.0 112.535 -176.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.531 ' SG ' ' HB2' ' A' ' 89' ' ' LYS . 28.7 p -119.83 1.73 11.02 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 122.45 0.3 . . . . 0.0 111.273 175.342 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 62.76 20.82 62.38 Favored Glycine 0 C--N 1.351 1.39 0 CA-C-O 120.065 -0.297 . . . . 0.0 113.388 -177.069 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.531 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 11.0 mmpt? -106.46 177.06 4.97 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.48 0.712 . . . . 0.0 110.534 -176.689 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.503 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 21.8 tpp85 -78.83 144.97 34.53 Favored 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 124.197 0.999 . . . . 0.0 110.415 177.409 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.453 HD13 ' HB2' ' A' ' 84' ' ' CYS . 5.3 mm -79.94 144.89 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 168.297 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 19.7 m -74.55 149.31 40.23 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 110.403 -0.221 . . . . 0.0 110.403 178.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.443 ' HG2' ' HE3' ' A' ' 97' ' ' LYS . 30.6 tt0 -60.07 -42.96 95.68 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.854 0.862 . . . . 0.0 110.598 174.09 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -57.21 -43.7 83.03 Favored 'General case' 0 N--CA 1.482 1.151 0 O-C-N 124.497 1.123 . . . . 0.0 110.546 176.414 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.549 ' HG3' HG21 ' A' ' 102' ' ' THR . 26.5 tpt180 -64.43 -43.37 94.54 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 114.488 -1.233 . . . . 0.0 110.869 179.074 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 75.2 mt -71.46 -33.68 69.54 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.302 0.641 . . . . 0.0 112.624 -176.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.443 ' HE3' ' HG2' ' A' ' 93' ' ' GLU . 16.4 ptpt -79.75 -27.74 40.51 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 122.248 -0.283 . . . . 0.0 110.56 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -80.34 -33.66 37.22 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.859 0.864 . . . . 0.0 111.21 177.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.4 p -157.57 97.04 1.98 Allowed Pre-proline 0 CA--C 1.556 1.197 0 C-N-CA 124.78 1.232 . . . . 0.0 108.248 179.187 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -75.28 -8.81 20.06 Favored 'Trans proline' 0 C--N 1.377 2.067 0 C-N-CA 122.671 2.248 . . . . 0.0 113.724 -179.342 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . 0.415 ' O ' ' HB1' ' A' ' 68' ' ' ALA . 35.1 p90 -105.74 45.6 0.96 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.434 0.693 . . . . 0.0 110.991 -178.268 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.549 HG21 ' HG3' ' A' ' 95' ' ' ARG . 15.2 t -116.92 101.79 53.28 Favored Pre-proline 0 CA--C 1.564 1.508 0 CA-C-O 121.149 0.5 . . . . 0.0 110.216 -178.56 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . 0.436 ' O ' ' HA ' ' A' ' 84' ' ' CYS . 32.4 Cg_exo -64.83 -24.54 61.22 Favored 'Trans proline' 0 C--N 1.378 2.109 0 C-N-CA 122.898 2.399 . . . . 0.0 113.317 174.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.401 ' HA ' ' SG ' ' A' ' 84' ' ' CYS . 6.6 m-85 -114.64 148.74 37.71 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.833 0.853 . . . . 0.0 109.297 -178.694 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.452 ' SG ' ' OE1' ' A' ' 107' ' ' GLU . 28.5 p -83.54 165.7 18.87 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 -178.482 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -46.78 -41.86 16.06 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 124.793 1.237 . . . . 0.0 114.204 -162.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 0.452 ' OE1' ' SG ' ' A' ' 105' ' ' CYS . 0.0 OUTLIER -82.95 -23.61 33.37 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-O 120.647 0.261 . . . . 0.0 111.556 -175.982 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.536 ' HB3' ' HD2' ' A' ' 86' ' ' LYS . 97.7 m -76.54 -29.83 56.87 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.23 1.012 . . . . 0.0 110.951 174.288 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -78.13 -34.57 49.84 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.505 0.722 . . . . 0.0 109.866 174.46 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.55 -21.72 61.12 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.874 0.87 . . . . 0.0 111.151 174.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.773 0 C-N-CA 123.778 0.831 . . . . 0.0 111.733 176.248 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 62.6 t30 . . . . . 0 N--CA 1.478 0.936 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 99.4 t -59.4 -34.0 53.0 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.079 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.145 177.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -58.4 -43.81 88.76 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 124.465 1.106 . . . . 0.0 112.249 -179.294 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.9 m -57.68 -40.38 79.29 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.031 0.532 . . . . 0.0 110.262 177.588 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.516 ' HA ' HG22 ' A' ' 15' ' ' ILE . 25.2 m-85 -75.62 -34.81 60.59 Favored 'General case' 0 C--O 1.214 -0.799 0 CA-C-N 115.1 -0.955 . . . . 0.0 110.816 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -57.53 -53.23 60.45 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.407 1.083 . . . . 0.0 110.089 -177.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.423 ' NZ ' ' HB2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -71.72 -42.75 66.93 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.711 -176.701 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.516 HG22 ' HA ' ' A' ' 12' ' ' TYR . 11.6 tt -62.92 -34.25 65.11 Favored 'Isoleucine or valine' 0 C--N 1.37 1.489 0 CA-C-N 118.588 0.631 . . . . 0.0 110.083 -177.13 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.578 ' HB3' HG23 ' A' ' 69' ' ' ILE . 56.9 mt -65.13 -43.2 92.69 Favored 'General case' 0 C--N 1.345 0.406 0 C-N-CA 123.224 0.609 . . . . 0.0 110.898 175.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.423 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 97.4 mtt180 -63.87 -47.46 80.57 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 123.717 0.636 . . . . 0.0 111.88 177.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -63.71 -42.57 97.93 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 122.976 0.51 . . . . 0.0 111.204 -178.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -39.97 81.05 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.786 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.671 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.2 pt20 -70.16 -35.37 73.96 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 119.301 -0.381 . . . . 0.0 110.535 -178.706 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 71.1 mtp180 -69.47 -41.5 76.12 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.588 0.755 . . . . 0.0 111.363 -175.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -66.68 -34.41 77.81 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 175.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.602 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 86.1 mt -69.42 -38.53 77.94 Favored 'General case' 0 C--O 1.216 -0.671 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.924 174.763 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -60.85 -46.31 91.09 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 122.992 0.517 . . . . 0.0 110.304 -177.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 -69.95 -31.52 69.3 Favored 'General case' 0 N--CA 1.483 1.197 0 O-C-N 123.492 0.495 . . . . 0.0 110.634 178.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 21.7 ttt85 -62.38 -59.48 4.94 Favored 'General case' 0 C--N 1.361 1.091 0 C-N-CA 123.533 0.733 . . . . 0.0 111.439 177.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.602 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 1.1 pp -80.19 -24.48 40.28 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 112.505 0.558 . . . . 0.0 112.505 -173.36 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 . . . . . 0 N--CA 1.494 1.745 0 C-N-CA 123.04 0.536 . . . . 0.0 109.693 174.436 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.8 mt . . . . . 0 N--CA 1.472 0.651 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -70.3 149.08 46.68 Favored Glycine 0 N--CA 1.472 1.087 0 CA-C-O 119.227 -0.763 . . . . 0.0 112.45 -177.234 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -50.72 -60.31 3.18 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.725 1.21 . . . . 0.0 112.51 -175.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.43 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 12.4 p -56.81 -35.03 44.95 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 123.202 0.601 . . . . 0.0 111.377 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -67.86 -41.13 88.98 Favored Glycine 0 C--N 1.347 1.165 0 O-C-N 123.883 0.739 . . . . 0.0 112.665 177.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -68.87 -43.78 74.64 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.629 0.771 . . . . 0.0 110.695 -177.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -68.2 -33.09 73.78 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.588 0.755 . . . . 0.0 110.749 178.144 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.43 ' HB2' ' O ' ' A' ' 61' ' ' VAL . 2.7 tp10 -69.79 -46.75 65.05 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.609 179.608 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.7 mp -60.59 -39.44 88.1 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 124.356 1.035 . . . . 0.0 110.47 174.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 74.0 ttt180 -64.24 -39.61 94.31 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.311 -179.124 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.19 -43.11 65.02 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.921 0.889 . . . . 0.0 110.985 178.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.671 HG21 ' HB3' ' A' ' 20' ' ' GLN . 69.9 mt -64.5 -55.86 19.22 Favored 'Isoleucine or valine' 0 C--N 1.356 0.855 0 C-N-CA 123.507 0.723 . . . . 0.0 110.174 -177.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -66.71 -25.29 66.45 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.089 0.955 . . . . 0.0 112.304 -179.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.17 -51.93 58.09 Favored 'General case' 0 N--CA 1.482 1.175 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 171.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.525 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -60.43 -42.42 96.03 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.317 1.047 . . . . 0.0 111.007 -179.042 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.501 HD23 HD12 ' A' ' 76' ' ' ILE . 88.1 mt -64.19 -39.41 93.94 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 124.56 1.144 . . . . 0.0 111.619 178.537 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.12 -37.66 88.17 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.383 0.673 . . . . 0.0 110.558 175.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.407 HH12 HG21 ' A' ' 85' ' ' VAL . 69.6 mtt-85 -73.05 -26.44 61.29 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.701 0.8 . . . . 0.0 111.055 178.494 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.525 HG13 ' O ' ' A' ' 72' ' ' ALA . 90.0 mt -66.33 -48.76 79.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 174.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.62 -35.17 80.04 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.909 179.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.8 t -78.19 -14.94 59.25 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 123.794 0.837 . . . . 0.0 111.437 177.2 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 82.23 6.19 88.99 Favored Glycine 0 C--N 1.351 1.385 0 C-N-CA 123.24 0.448 . . . . 0.0 113.908 177.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.5 t -104.28 15.17 28.87 Favored 'General case' 0 CA--C 1.555 1.172 0 C-N-CA 124.311 1.045 . . . . 0.0 111.323 -177.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -67.16 151.85 46.81 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 169.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 72.29 20.58 79.3 Favored Glycine 0 C--N 1.344 1.009 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.775 -176.473 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 30.5 m -128.12 111.37 13.4 Favored 'General case' 0 C--N 1.353 0.742 0 C-N-CA 124.179 0.992 . . . . 0.0 109.65 178.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . 0.444 ' HB2' HD13 ' A' ' 91' ' ' ILE . 44.2 t -72.71 93.18 1.62 Allowed 'General case' 0 C--O 1.244 0.769 0 C-N-CA 123.878 0.871 . . . . 0.0 110.094 173.13 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.407 HG21 HH12 ' A' ' 75' ' ' ARG . 25.6 m -61.07 -24.4 32.97 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 CA-C-N 114.438 -1.255 . . . . 0.0 112.843 -178.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 47.7 tttm -71.9 -14.79 62.04 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.055 0.542 . . . . 0.0 112.116 -176.204 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.467 ' SG ' ' HB2' ' A' ' 89' ' ' LYS . 27.7 p -137.11 5.57 2.79 Favored 'General case' 0 N--CA 1.486 1.374 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 173.322 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 65.04 17.2 63.07 Favored Glycine 0 C--N 1.357 1.728 0 N-CA-C 113.819 0.288 . . . . 0.0 113.819 -178.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.467 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 31.8 mmmt -101.34 165.19 11.4 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.756 0.822 . . . . 0.0 109.415 -179.028 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 25.6 mmt180 -80.41 149.6 30.1 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 123.001 0.521 . . . . 0.0 110.42 172.079 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.444 HD13 ' HB2' ' A' ' 84' ' ' CYS . 5.3 mm -78.16 145.62 9.5 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 172.558 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 17.2 m -75.21 151.39 38.45 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.127 0.571 . . . . 0.0 109.744 177.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -64.25 -41.06 97.12 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 122.624 0.37 . . . . 0.0 110.672 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.456 ' HA ' ' HG2' ' A' ' 97' ' ' LYS . 24.7 m-20 -71.44 -31.71 67.51 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 123.771 0.67 . . . . 0.0 111.213 -179.465 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.422 ' HE ' HG21 ' A' ' 102' ' ' THR . 29.0 tpt180 -64.02 -37.17 86.44 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.433 0.693 . . . . 0.0 110.588 170.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 55.6 mt -77.68 -40.91 39.96 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.175 0.59 . . . . 0.0 112.278 -178.484 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.456 ' HG2' ' HA ' ' A' ' 94' ' ' ASP . 15.2 ptpt -70.79 -27.61 64.04 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-O 120.757 0.313 . . . . 0.0 110.223 -177.295 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.7 -50.69 8.99 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.693 0.797 . . . . 0.0 110.755 173.234 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.411 ' O ' HG22 ' A' ' 102' ' ' THR . 0.5 OUTLIER -130.2 86.0 55.34 Favored Pre-proline 0 CA--C 1.558 1.275 0 C-N-CA 124.087 0.955 . . . . 0.0 108.724 -175.449 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -77.89 -7.15 16.37 Favored 'Trans proline' 0 C--N 1.37 1.707 0 C-N-CA 122.383 2.055 . . . . 0.0 114.077 -177.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 16.3 p90 -103.12 -8.63 20.34 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -176.567 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.422 HG21 ' HE ' ' A' ' 95' ' ' ARG . 15.1 t -73.5 125.28 90.74 Favored Pre-proline 0 CA--C 1.56 1.331 0 CA-C-N 117.896 0.316 . . . . 0.0 110.398 -175.546 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -79.15 -7.91 15.25 Favored 'Trans proline' 0 C--N 1.371 1.724 0 C-N-CA 122.517 2.145 . . . . 0.0 111.98 172.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -116.32 140.08 49.71 Favored 'General case' 0 C--N 1.353 0.723 0 C-N-CA 123.855 0.862 . . . . 0.0 110.281 -175.157 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 20.6 p -75.43 167.09 22.56 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 174.508 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -50.55 -41.49 54.19 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.798 0.839 . . . . 0.0 112.106 -174.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -65.48 -44.27 87.64 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.2 1.0 . . . . 0.0 110.396 -175.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 86.8 m -69.26 -39.34 78.49 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.23 0.612 . . . . 0.0 111.103 177.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.88 -30.99 71.68 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.576 0.75 . . . . 0.0 111.399 177.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -74.46 -34.69 63.21 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.893 0.877 . . . . 0.0 110.598 174.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.548 0.893 0 C-N-CA 123.881 0.872 . . . . 0.0 111.939 178.489 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 15.9 p-10 . . . . . 0 CA--C 1.548 0.874 0 CA-C-O 121.9 0.857 . . . . 0.0 110.273 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 42.5 t -69.69 -27.56 34.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.485 -179.302 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -52.98 -38.49 62.24 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.073 0.949 . . . . 0.0 111.695 179.399 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 16.6 m -60.42 -43.48 96.71 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.932 175.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.459 ' HA ' HG22 ' A' ' 15' ' ' ILE . 25.4 m-85 -72.18 -32.69 67.05 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.996 179.663 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.608 ' HG2' HD13 ' A' ' 76' ' ' ILE . 39.5 mt-10 -59.3 -56.25 24.44 Favored 'General case' 0 N--CA 1.492 1.636 0 CA-C-O 121.434 0.635 . . . . 0.0 110.809 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -66.47 -44.44 82.71 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.134 -176.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.459 HG22 ' HA ' ' A' ' 12' ' ' TYR . 10.3 tt -67.49 -32.7 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.242 0 C-N-CA 122.514 0.326 . . . . 0.0 110.574 -174.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.535 ' HB3' HG23 ' A' ' 69' ' ' ILE . 31.2 mt -65.2 -46.09 82.15 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.093 0.557 . . . . 0.0 110.635 175.103 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 51.2 mtm-85 -63.82 -41.91 97.77 Favored 'General case' 0 C--O 1.217 -0.628 0 O-C-N 123.605 0.566 . . . . 0.0 110.81 179.402 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -61.54 -36.27 80.1 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.317 0.647 . . . . 0.0 111.218 177.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -81.15 -28.84 34.89 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.258 -178.535 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.642 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.4 pt20 -78.04 -25.09 47.62 Favored 'General case' 0 C--O 1.207 -1.16 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 173.546 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 72.9 mtt180 -66.82 -49.48 65.67 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.056 0.542 . . . . 0.0 110.589 176.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -65.75 -37.46 86.42 Favored 'General case' 0 N--CA 1.478 0.968 0 O-C-N 123.533 0.521 . . . . 0.0 110.88 178.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.59 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 58.0 mt -67.96 -46.23 71.97 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 119.155 -0.45 . . . . 0.0 111.147 175.411 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.422 ' O ' ' HB2' ' A' ' 28' ' ' HIS . 3.8 m-85 -58.13 -50.53 73.18 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.173 0.589 . . . . 0.0 110.094 -177.579 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 19.7 ptt180 -68.79 -28.15 66.51 Favored 'General case' 0 N--CA 1.48 1.057 0 O-C-N 123.525 0.515 . . . . 0.0 111.172 -178.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 14.8 ttm180 -62.97 -59.05 5.35 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.083 0.553 . . . . 0.0 110.403 175.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.59 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 1.6 pp -80.99 -8.37 59.76 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.986 -176.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.422 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 17.9 m170 . . . . . 0 N--CA 1.479 0.997 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 170.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.535 HD22 HD13 ' A' ' 27' ' ' LEU . 4.6 mt . . . . . 0 N--CA 1.476 0.86 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -97.53 161.71 21.36 Favored Glycine 0 N--CA 1.478 1.452 0 CA-C-O 119.493 -0.615 . . . . 0.0 112.181 173.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -64.77 -64.3 0.91 Allowed 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.231 0.612 . . . . 0.0 111.722 -173.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 9.3 p -59.32 -29.76 42.64 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 C-N-CA 123.89 0.876 . . . . 0.0 110.726 177.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.522 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -60.45 -51.73 56.96 Favored Glycine 0 C--N 1.348 1.25 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.164 175.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -69.9 -40.72 75.45 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.714 0.806 . . . . 0.0 112.024 -177.307 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -67.04 -44.05 81.19 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 123.92 0.763 . . . . 0.0 110.264 -174.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -70.43 -38.44 74.57 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.235 177.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.554 HD22 HD21 ' A' ' 27' ' ' LEU . 14.9 tp -58.23 -46.26 86.22 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 124.738 1.215 . . . . 0.0 111.137 178.525 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 31.1 ttt180 -75.94 -31.84 59.28 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 114.004 -1.453 . . . . 0.0 110.024 -175.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -68.28 -39.35 82.17 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 123.915 0.759 . . . . 0.0 110.717 174.533 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.642 HG21 ' HB3' ' A' ' 20' ' ' GLN . 80.9 mt -63.51 -47.7 90.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.523 0.729 . . . . 0.0 109.569 175.46 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -63.37 -35.59 80.91 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.813 -179.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.15 -39.99 75.02 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.757 0.823 . . . . 0.0 110.971 177.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.498 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -68.1 -43.3 78.78 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.61 0.764 . . . . 0.0 110.746 -179.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 84.7 mt -61.38 -39.11 89.46 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.288 1.035 . . . . 0.0 111.164 175.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.61 -37.12 86.49 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.624 175.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 67.3 mtt85 -69.98 -29.04 66.03 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.599 0.76 . . . . 0.0 111.509 176.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.608 HD13 ' HG2' ' A' ' 13' ' ' GLU . 62.3 mt -70.3 -44.79 77.3 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 177.394 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.89 -27.41 67.48 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 115.329 -0.851 . . . . 0.0 111.218 176.513 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.9 t -84.13 -18.23 37.46 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.729 0.812 . . . . 0.0 110.804 174.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 82.42 7.94 86.91 Favored Glycine 0 C--N 1.348 1.229 0 C-N-CA 123.084 0.373 . . . . 0.0 113.937 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.2 t -112.95 31.32 6.49 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 124.196 0.998 . . . . 0.0 110.402 -179.029 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -64.5 146.55 54.39 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.714 170.509 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.478 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 73.16 37.03 55.76 Favored Glycine 0 C--N 1.343 0.933 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.955 -177.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 41.0 m -121.73 116.27 24.21 Favored 'General case' 0 C--O 1.242 0.679 0 C-N-CA 123.279 0.632 . . . . 0.0 109.668 177.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 44.4 t -67.33 102.29 1.07 Allowed 'General case' 0 C--N 1.349 0.563 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 169.076 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 33.7 m -63.43 -30.28 49.39 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 O-C-N 124.242 0.964 . . . . 0.0 111.947 -177.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -73.66 -13.7 61.03 Favored 'General case' 0 CA--C 1.557 1.241 0 C-N-CA 123.609 0.763 . . . . 0.0 111.432 177.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 57.5 m -111.17 -23.29 10.96 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.768 0.827 . . . . 0.0 111.534 175.038 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 64.56 20.87 66.34 Favored Glycine 0 CA--C 1.537 1.464 0 CA-C-N 116.545 -0.298 . . . . 0.0 112.986 -165.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 46.6 mtmt -126.89 -177.56 4.07 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.978 0.911 . . . . 0.0 110.491 -172.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.478 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 18.7 tpp180 -72.9 152.67 41.34 Favored 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 124.663 1.185 . . . . 0.0 111.658 -178.192 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 17.6 mm -92.72 149.68 4.11 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.017 0 C-N-CA 124.978 1.311 . . . . 0.0 109.406 170.371 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.3 m -64.59 145.13 56.61 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 122.965 0.506 . . . . 0.0 110.25 174.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -58.5 -42.81 88.51 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.257 0.623 . . . . 0.0 110.839 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.501 ' HA ' ' HG2' ' A' ' 97' ' ' LYS . 16.2 m-20 -68.31 -33.11 73.73 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.83 -179.659 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.409 ' HG3' HG21 ' A' ' 102' ' ' THR . 24.6 tpt180 -68.35 -31.78 71.42 Favored 'General case' 0 CA--C 1.547 0.864 0 O-C-N 123.635 0.584 . . . . 0.0 110.217 173.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.41 HD21 ' HA2' ' A' ' 82' ' ' GLY . 90.9 mt -80.34 -37.06 33.21 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 118.189 0.45 . . . . 0.0 112.171 179.447 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.501 ' HG2' ' HA ' ' A' ' 94' ' ' ASP . 16.5 ptpt -75.32 -28.66 59.74 Favored 'General case' 0 N--CA 1.485 1.296 0 CA-C-O 120.882 0.373 . . . . 0.0 110.077 -177.514 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -91.37 -41.37 10.94 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.721 0.809 . . . . 0.0 111.296 178.736 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 3.8 t -132.54 76.04 72.49 Favored Pre-proline 0 CA--C 1.56 1.357 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 -175.516 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -74.02 0.9 7.77 Favored 'Trans proline' 0 C--N 1.373 1.84 0 C-N-CA 122.579 2.186 . . . . 0.0 114.123 -174.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 22.8 p90 -108.18 -8.61 15.72 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.445 0.698 . . . . 0.0 112.599 -176.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.409 HG21 ' HG3' ' A' ' 95' ' ' ARG . 14.7 t -65.62 123.18 83.91 Favored Pre-proline 0 CA--C 1.566 1.578 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -170.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -76.47 -19.23 15.05 Favored 'Trans proline' 0 C--N 1.377 2.05 0 C-N-CA 122.482 2.121 . . . . 0.0 112.041 171.255 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.401 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 6.9 m-85 -113.02 162.93 15.32 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.848 0.859 . . . . 0.0 109.766 -176.191 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 31.1 p -92.32 168.38 11.35 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 175.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -55.13 -32.46 62.09 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.618 0.767 . . . . 0.0 111.905 -178.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -67.74 -45.29 75.4 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.757 0.823 . . . . 0.0 109.917 178.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.401 ' HB2' ' HB3' ' A' ' 104' ' ' PHE . 91.6 m -69.65 -30.61 68.34 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.411 177.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.0 -32.4 74.1 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.419 0.688 . . . . 0.0 110.772 173.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -80.79 -21.16 41.2 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.588 0.755 . . . . 0.0 111.3 173.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.142 0 C-N-CA 123.745 0.818 . . . . 0.0 112.47 -178.718 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 16.4 m120 . . . . . 0 N--CA 1.473 0.703 0 CA-C-O 121.699 0.761 . . . . 0.0 109.054 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 44.3 t -65.24 -26.04 38.71 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-N 114.35 -1.295 . . . . 0.0 111.795 -170.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -61.87 -31.02 71.26 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.351 0.66 . . . . 0.0 112.572 179.353 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.4 m -66.96 -40.24 87.44 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 121.395 0.617 . . . . 0.0 109.869 172.528 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -72.64 -30.24 64.14 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.749 178.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.529 ' HG2' HD13 ' A' ' 76' ' ' ILE . 41.2 mt-10 -66.49 -52.44 45.97 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 122.95 0.5 . . . . 0.0 110.385 -179.254 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -65.39 -41.56 93.58 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 123.938 0.774 . . . . 0.0 111.687 -176.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 12.0 tt -65.0 -34.82 73.2 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 CA-C-O 120.727 0.298 . . . . 0.0 110.281 -178.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.5 mt -69.24 -38.26 78.4 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 122.77 0.428 . . . . 0.0 111.119 176.161 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -58.83 -50.41 74.09 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.005 0.522 . . . . 0.0 110.268 175.276 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -61.35 -47.9 83.76 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.451 0.7 . . . . 0.0 111.669 -179.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.77 -40.69 98.08 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.452 0.701 . . . . 0.0 111.404 -178.203 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.666 ' HB3' HG21 ' A' ' 69' ' ' ILE . 3.0 pt20 -76.05 -32.34 59.26 Favored 'General case' 0 C--O 1.214 -0.815 0 CA-C-O 119.045 -0.502 . . . . 0.0 111.432 -177.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.0 mmt180 -76.24 -36.01 58.71 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 117.97 0.35 . . . . 0.0 111.365 -176.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -67.93 -41.19 82.96 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 174.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.51 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 75.6 mt -65.5 -43.02 91.47 Favored 'General case' 0 C--N 1.354 0.78 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.391 174.39 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -58.36 -54.0 51.98 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.862 0.865 . . . . 0.0 110.702 -175.561 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.9 ptt180 -69.11 -27.61 65.73 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 123.742 0.651 . . . . 0.0 111.224 -178.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 44.0 ttt85 -66.23 -58.32 5.65 Favored 'General case' 0 C--N 1.362 1.11 0 C-N-CA 122.919 0.488 . . . . 0.0 111.269 176.363 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.638 HD21 HD22 ' A' ' 66' ' ' LEU . 4.0 pp -72.76 -26.52 61.58 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 122.86 0.464 . . . . 0.0 111.022 -175.611 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 42.9 m-70 . . . . . 0 N--CA 1.484 1.25 0 C-N-CA 123.095 0.558 . . . . 0.0 111.376 173.012 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.447 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 59.8 mt . . . . . 0 CA--C 1.546 0.82 0 N-CA-C 110.597 -0.149 . . . . 0.0 110.597 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 129.7 124.7 2.65 Favored Glycine 0 N--CA 1.474 1.227 0 N-CA-C 111.375 -0.69 . . . . 0.0 111.375 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -66.05 -38.19 87.73 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -164.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 6.1 p -62.36 -39.4 84.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 CA-C-N 118.399 0.545 . . . . 0.0 110.692 177.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.481 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -66.39 -49.89 53.66 Favored Glycine 0 C--N 1.344 0.98 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.632 176.463 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -67.23 -35.72 80.14 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 124.593 1.157 . . . . 0.0 112.24 -174.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -73.11 -48.69 33.52 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.577 -176.063 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -64.96 -34.57 78.73 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 115.013 -0.994 . . . . 0.0 109.74 177.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.638 HD22 HD21 ' A' ' 27' ' ' LEU . 13.9 tp -60.84 -46.02 92.23 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.691 1.197 . . . . 0.0 109.911 175.517 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 51.7 ttt180 -61.92 -38.09 87.12 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.172 0.989 . . . . 0.0 110.93 -178.469 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.16 -43.26 99.17 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 123.81 0.694 . . . . 0.0 110.253 176.093 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.666 HG21 ' HB3' ' A' ' 20' ' ' GLN . 85.1 mt -65.2 -45.49 93.69 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.871 179.076 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -66.14 -33.09 74.98 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.912 0.885 . . . . 0.0 111.123 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.58 -35.89 73.28 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.093 0.957 . . . . 0.0 110.243 177.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.431 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -68.44 -47.28 67.59 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.64 177.348 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.505 HD23 HD12 ' A' ' 76' ' ' ILE . 88.2 mt -63.24 -33.76 76.19 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 124.192 0.997 . . . . 0.0 111.491 177.115 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.0 -41.24 95.57 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.667 0.787 . . . . 0.0 110.355 175.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 89.1 mtm180 -68.82 -30.43 68.97 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.382 0.673 . . . . 0.0 111.604 176.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.529 HD13 ' HG2' ' A' ' 13' ' ' GLU . 75.1 mt -68.99 -42.63 82.22 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 176.499 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.53 -34.25 77.81 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.767 176.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.8 t -82.0 -12.79 58.14 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 124.035 0.934 . . . . 0.0 111.114 178.268 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 75.71 9.64 84.88 Favored Glycine 0 C--N 1.353 1.521 0 C-N-CA 123.086 0.375 . . . . 0.0 113.627 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 15.2 t -112.42 28.18 9.0 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.24 1.016 . . . . 0.0 109.774 -177.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -66.45 144.41 56.51 Favored 'General case' 0 C--N 1.348 0.527 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.901 172.291 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.585 ' HA2' HD21 ' A' ' 96' ' ' LEU . . . 77.87 37.27 30.12 Favored Glycine 0 C--N 1.34 0.77 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.769 -172.256 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 93.9 m -123.79 118.26 26.77 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.557 0.743 . . . . 0.0 110.586 177.181 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . 0.667 ' SG ' ' SG ' ' A' ' 105' ' ' CYS . 48.8 t -62.02 92.85 0.04 OUTLIER 'General case' 0 C--N 1.352 0.699 0 C-N-CA 124.927 1.291 . . . . 0.0 108.239 166.725 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 33.1 m -62.88 -27.33 42.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 124.003 0.921 . . . . 0.0 112.25 -173.211 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 59.4 tttm -70.48 -20.63 62.85 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.25 1.02 . . . . 0.0 111.573 178.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.544 ' SG ' ' SG ' ' A' ' 84' ' ' CYS . 11.8 m -120.48 -13.54 8.79 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 123.959 0.903 . . . . 0.0 111.342 -174.172 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 60.83 31.6 76.42 Favored Glycine 0 C--N 1.353 1.473 0 CA-C-N 116.48 -0.327 . . . . 0.0 113.266 -173.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -135.74 -174.49 3.67 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.761 0.824 . . . . 0.0 110.691 -176.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.471 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 4.3 tpp180 -74.7 151.93 39.17 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.854 0.862 . . . . 0.0 112.918 -169.885 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 23.9 mm -95.48 148.85 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 124.345 1.058 . . . . 0.0 108.513 167.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.4 m -71.75 145.46 48.74 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.643 0.777 . . . . 0.0 110.05 177.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -58.32 -41.03 83.65 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.245 0.618 . . . . 0.0 110.929 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -62.55 -38.97 92.11 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.324 1.05 . . . . 0.0 111.101 179.318 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.447 ' HE ' HG21 ' A' ' 102' ' ' THR . 25.5 tpt180 -69.66 -33.46 72.62 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.74 178.604 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.585 HD21 ' HA2' ' A' ' 82' ' ' GLY . 87.0 mt -73.17 -45.23 57.77 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 122.817 0.447 . . . . 0.0 111.421 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -71.32 -28.46 64.11 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 122.808 0.443 . . . . 0.0 110.938 -175.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -88.34 -47.16 8.6 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.336 0.654 . . . . 0.0 111.058 178.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 1.7 t -129.87 79.66 72.81 Favored Pre-proline 0 CA--C 1.559 1.308 0 C-N-CA 124.029 0.931 . . . . 0.0 108.639 -175.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -73.37 -8.17 21.45 Favored 'Trans proline' 0 C--N 1.372 1.774 0 C-N-CA 122.285 1.99 . . . . 0.0 113.445 -177.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 26.6 p90 -100.86 -8.69 22.35 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -176.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.447 HG21 ' HE ' ' A' ' 95' ' ' ARG . 13.8 t -62.06 122.17 70.57 Favored Pre-proline 0 CA--C 1.563 1.443 0 O-C-N 123.129 0.268 . . . . 0.0 111.365 -172.152 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -66.44 -37.85 21.75 Favored 'Trans proline' 0 C--N 1.376 2.026 0 C-N-CA 122.461 2.107 . . . . 0.0 111.371 173.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -99.57 -179.49 4.22 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.694 -178.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.732 ' SG ' ' HB2' ' A' ' 108' ' ' CYS . 15.0 p -98.71 179.64 4.6 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 124.875 1.27 . . . . 0.0 109.227 173.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -64.86 -55.51 19.04 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 118.051 0.387 . . . . 0.0 111.459 -177.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.06 -34.25 76.08 Favored 'General case' 0 N--CA 1.483 1.225 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -175.068 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.732 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 68.3 m -81.04 -22.95 38.91 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 179.433 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -78.74 -24.23 44.94 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 171.439 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -81.87 -27.4 33.5 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.605 0.762 . . . . 0.0 110.797 172.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.677 0 C-N-CA 124.137 0.975 . . . . 0.0 109.959 -179.859 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.409 HD13 ' OG1' ' A' ' 83' ' ' THR . 8.2 tt . . . . . 0 N--CA 1.478 0.971 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -78.98 99.12 6.7 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 174.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -157.71 73.19 0.23 Allowed Glycine 0 C--N 1.345 1.083 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -178.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -76.73 -35.38 40.56 Favored Glycine 0 C--N 1.347 1.192 0 O-C-N 123.837 0.375 . . . . 0.0 113.043 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -83.75 156.68 22.43 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.318 0.647 . . . . 0.0 110.472 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 67.4 m 68.69 134.88 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.635 1.574 . . . . 0.0 112.122 -176.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . 0.474 ' HG3' HD12 ' A' ' 96' ' ' LEU . 15.4 tmm? 64.98 93.86 0.06 Allowed 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.401 1.081 . . . . 0.0 110.539 179.532 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -71.35 99.92 2.06 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.837 -175.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 59.8 t -59.25 -35.7 59.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 124.039 0.936 . . . . 0.0 112.113 -174.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -56.51 -43.31 79.64 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.361 0.664 . . . . 0.0 111.601 -174.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.8 m -58.17 -43.8 87.65 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 123.989 0.806 . . . . 0.0 110.798 178.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.518 ' HA ' HG22 ' A' ' 15' ' ' ILE . 36.6 m-85 -74.24 -37.22 63.86 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.989 -176.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -57.59 -51.31 70.0 Favored 'General case' 0 C--O 1.244 0.802 0 C-N-CA 124.823 1.249 . . . . 0.0 110.497 -177.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.415 ' NZ ' ' HB2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -71.49 -42.45 68.03 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.276 -0.875 . . . . 0.0 111.568 -177.661 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.518 HG22 ' HA ' ' A' ' 12' ' ' TYR . 9.2 tt -67.68 -28.52 42.02 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 CA-C-N 118.474 0.579 . . . . 0.0 110.723 -177.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 42.1 mt -63.12 -47.41 82.93 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.299 0.64 . . . . 0.0 110.27 172.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.52 ' O ' ' HG3' ' A' ' 21' ' ' ARG . 48.2 mtm105 -62.57 -42.56 99.62 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 123.953 0.783 . . . . 0.0 111.229 176.186 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -59.74 -45.4 92.31 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 122.889 0.476 . . . . 0.0 110.198 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? -67.28 -42.11 84.34 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.776 -177.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.67 ' HB3' HG21 ' A' ' 69' ' ' ILE . 3.2 pt20 -71.13 -36.0 71.93 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-O 118.82 -0.609 . . . . 0.0 110.531 -174.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.617 ' HG2' ' HG2' ' A' ' 48' ' ' GLU . 53.7 mtp180 -75.67 -39.6 57.33 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 123.791 0.682 . . . . 0.0 111.934 -173.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -64.2 -40.02 95.2 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 123.459 0.475 . . . . 0.0 109.869 174.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.508 ' HB2' HD11 ' A' ' 66' ' ' LEU . 98.8 mt -72.78 -29.82 63.6 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.44 175.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.434 ' HB2' ' HA ' ' A' ' 21' ' ' ARG . 1.4 m-85 -65.5 -54.79 23.29 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.478 0.711 . . . . 0.0 109.498 178.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -66.35 -27.29 67.77 Favored 'General case' 0 N--CA 1.482 1.164 0 O-C-N 123.939 0.774 . . . . 0.0 110.758 -177.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -58.77 -52.76 64.35 Favored 'General case' 0 C--N 1.356 0.882 0 O-C-N 124.077 0.86 . . . . 0.0 110.695 173.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 3.2 pp -87.32 -11.79 48.43 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 31.0 m170 -92.66 17.29 10.48 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 123.866 0.866 . . . . 0.0 110.835 175.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.58 -27.27 25.61 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 124.001 0.92 . . . . 0.0 112.523 177.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.464 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -67.32 -40.61 85.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 123.601 0.761 . . . . 0.0 111.721 179.062 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.423 ' N ' HG12 ' A' ' 30' ' ' ILE . 12.5 pt-20 -106.07 -4.96 19.83 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.995 0.918 . . . . 0.0 111.418 -173.186 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -124.6 99.77 6.33 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.403 0.681 . . . . 0.0 109.468 -179.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -70.1 -31.69 69.38 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.47 0.708 . . . . 0.0 109.93 171.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -78.41 119.84 22.3 Favored 'General case' 0 C--O 1.244 0.811 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.403 -178.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -125.36 -16.62 5.85 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 123.382 0.673 . . . . 0.0 110.373 176.009 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 65.04 147.92 0.11 Allowed Pre-proline 0 CA--C 1.566 1.564 0 C-N-CA 125.979 1.711 . . . . 0.0 112.5 -175.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -57.99 -58.04 0.94 Allowed 'Trans proline' 0 C--N 1.383 2.389 0 C-N-CA 122.565 2.177 . . . . 0.0 111.704 171.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 80.2 mmt-85 -132.89 -84.56 0.47 Allowed 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.86 0.864 . . . . 0.0 109.336 174.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 37.6 p30 -72.96 157.88 87.99 Favored Pre-proline 0 N--CA 1.482 1.147 0 C-N-CA 123.879 0.872 . . . . 0.0 111.49 -173.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -65.56 -13.16 38.4 Favored 'Trans proline' 0 C--N 1.38 2.236 0 C-N-CA 122.411 2.074 . . . . 0.0 112.936 172.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 22.3 t70 77.2 -65.59 0.27 Allowed 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 125.966 1.706 . . . . 0.0 110.414 -176.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -78.61 -173.83 3.58 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.954 0.902 . . . . 0.0 111.039 178.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -62.54 -64.0 1.06 Allowed 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 123.853 0.861 . . . . 0.0 111.135 -178.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -174.77 136.91 0.43 Allowed 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.646 0.778 . . . . 0.0 110.392 -172.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 18.4 mmt180 -91.34 86.62 6.17 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 174.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.32 78.03 2.41 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-O 121.639 0.733 . . . . 0.0 110.81 -177.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 39.2 m -147.19 23.55 1.17 Allowed 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.858 1.263 . . . . 0.0 109.03 177.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.617 ' HG2' ' HG2' ' A' ' 21' ' ' ARG . 9.1 tp10 -84.85 148.64 26.18 Favored 'General case' 0 C--N 1.349 0.576 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.298 -171.433 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 42.6 ttp180 58.49 23.1 10.36 Favored 'General case' 0 CA--C 1.564 1.509 0 C-N-CA 124.833 1.253 . . . . 0.0 111.144 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.8 t -85.83 -9.42 57.05 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.152 0.981 . . . . 0.0 110.988 -176.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -96.26 99.97 11.64 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 179.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -90.58 68.27 6.59 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 121.972 0.892 . . . . 0.0 109.169 177.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -139.46 159.9 41.08 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 124.456 1.102 . . . . 0.0 109.284 174.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 93.6 t -78.12 -64.34 0.92 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 C-N-CA 123.36 0.664 . . . . 0.0 109.423 175.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.3 tp 57.17 117.75 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 125.655 1.582 . . . . 0.0 113.219 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -74.98 -21.09 59.36 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 124.139 0.976 . . . . 0.0 111.386 -175.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -71.09 -16.85 62.6 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.075 0.55 . . . . 0.0 112.341 177.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.501 ' HB2' ' NE2' ' A' ' 63' ' ' GLN . 18.1 mt -75.02 130.92 40.16 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 173.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -59.4 124.98 38.15 Favored Glycine 0 C--N 1.353 1.492 0 CA-C-O 118.808 -0.995 . . . . 0.0 111.521 177.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -62.49 -32.71 73.66 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 123.552 0.741 . . . . 0.0 112.22 -174.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.434 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 8.7 p -62.84 -39.04 83.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 123.251 0.62 . . . . 0.0 110.156 174.318 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -73.23 -43.11 40.3 Favored Glycine 0 C--N 1.348 1.198 0 O-C-N 123.686 0.616 . . . . 0.0 111.969 179.121 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.501 ' NE2' ' HB2' ' A' ' 58' ' ' LEU . 99.4 mt-30 -59.89 -45.34 92.84 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.028 0.931 . . . . 0.0 110.725 177.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -67.7 -40.57 84.31 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.121 0.968 . . . . 0.0 110.474 -178.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.434 ' HB2' ' O ' ' A' ' 61' ' ' VAL . 3.1 tp10 -65.15 -42.1 94.1 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.624 178.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.508 HD11 ' HB2' ' A' ' 23' ' ' LEU . 0.8 OUTLIER -70.31 -29.97 66.84 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.693 1.197 . . . . 0.0 111.35 179.927 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 41.9 ttt180 -69.4 -38.69 78.07 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 123.856 0.722 . . . . 0.0 109.665 175.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.85 -37.55 76.17 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.675 0.79 . . . . 0.0 111.038 177.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.67 HG21 ' HB3' ' A' ' 20' ' ' GLN . 98.7 mt -68.95 -40.29 80.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 123.61 0.764 . . . . 0.0 110.016 175.303 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -66.74 -39.21 87.86 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.7 0.8 . . . . 0.0 110.17 -178.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.58 -41.85 92.42 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.632 0.773 . . . . 0.0 110.493 176.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.433 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -65.28 -45.82 82.9 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.874 0.869 . . . . 0.0 111.186 179.463 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.498 HD23 HD12 ' A' ' 76' ' ' ILE . 80.5 mt -65.53 -31.99 73.34 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.161 0.984 . . . . 0.0 111.222 177.278 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.6 -34.07 69.56 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.479 0.712 . . . . 0.0 110.951 177.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -65.38 -36.19 83.22 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.006 0.522 . . . . 0.0 110.213 172.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.498 HD12 HD23 ' A' ' 73' ' ' LEU . 55.8 mt -66.68 -43.7 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 177.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.83 -30.44 71.49 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.533 1.133 . . . . 0.0 111.539 175.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.9 t -85.07 -17.27 37.92 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.833 0.853 . . . . 0.0 111.115 177.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 82.15 13.29 79.37 Favored Glycine 0 C--N 1.347 1.188 0 C-N-CA 123.412 0.53 . . . . 0.0 113.549 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 12.4 t -125.14 33.39 5.18 Favored 'General case' 0 CA--C 1.556 1.18 0 C-N-CA 124.176 0.99 . . . . 0.0 110.718 -177.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -62.84 144.32 56.72 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 121.91 -0.494 . . . . 0.0 110.087 165.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.21 31.06 32.34 Favored Glycine 0 C--N 1.341 0.848 0 O-C-N 123.965 0.791 . . . . 0.0 111.359 -171.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . 0.409 ' OG1' HD13 ' A' ' 1' ' ' LEU . 9.7 m -130.46 114.55 15.67 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.717 0.807 . . . . 0.0 110.203 175.34 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 44.1 t -61.13 106.16 0.57 Allowed 'General case' 0 C--N 1.351 0.667 0 C-N-CA 124.101 0.96 . . . . 0.0 109.131 170.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 26.8 m -59.09 -31.01 44.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 O-C-N 124.236 0.96 . . . . 0.0 110.995 177.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 36.0 tttm -80.22 -7.56 59.04 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.084 0.953 . . . . 0.0 111.624 -176.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 62.8 m -119.83 -24.25 6.2 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 124.023 0.929 . . . . 0.0 111.91 174.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 65.04 27.8 72.74 Favored Glycine 0 CA--C 1.537 1.461 0 O-C-N 123.423 0.452 . . . . 0.0 112.103 -165.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -134.42 172.94 12.2 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.747 0.819 . . . . 0.0 110.133 -171.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.54 151.71 44.77 Favored 'General case' 0 CA--C 1.573 1.838 0 C-N-CA 124.377 1.071 . . . . 0.0 111.468 -172.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 8.7 mm -99.21 152.09 4.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 C-N-CA 125.237 1.415 . . . . 0.0 109.807 174.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.1 m -72.33 142.76 48.82 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 122.985 0.514 . . . . 0.0 109.737 173.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 46.2 tt0 -66.47 -32.14 73.32 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.866 0.466 . . . . 0.0 110.211 175.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.434 ' HA ' ' HE3' ' A' ' 97' ' ' LYS . 35.7 m-20 -66.83 -34.95 78.94 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.737 0.815 . . . . 0.0 111.393 175.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -60.77 -45.15 95.46 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 123.948 0.78 . . . . 0.0 110.297 173.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.474 HD12 ' HG3' ' A' ' 7' ' ' MET . 98.3 mt -81.64 -27.25 34.21 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 -173.354 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.434 ' HE3' ' HA ' ' A' ' 94' ' ' ASP . 16.9 ptpt -73.69 -31.39 63.41 Favored 'General case' 0 N--CA 1.483 1.207 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 177.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.44 -43.36 19.01 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.769 0.828 . . . . 0.0 110.838 176.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.2 p -150.18 94.88 3.67 Favored Pre-proline 0 CA--C 1.556 1.179 0 C-N-CA 124.477 1.111 . . . . 0.0 109.325 -178.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -76.05 -10.14 19.47 Favored 'Trans proline' 0 C--N 1.379 2.173 0 C-N-CA 122.574 2.183 . . . . 0.0 112.967 177.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . 0.42 ' HB3' HG12 ' A' ' 69' ' ' ILE . 15.3 p90 -101.8 48.91 0.87 Allowed 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.835 0.854 . . . . 0.0 110.545 -176.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 10.1 t -129.77 116.22 18.13 Favored Pre-proline 0 CA--C 1.55 0.968 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.383 171.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -76.16 -0.06 9.91 Favored 'Trans proline' 0 C--N 1.372 1.792 0 C-N-CA 122.348 2.032 . . . . 0.0 111.933 170.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.427 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 9.6 m-85 -115.56 146.36 41.81 Favored 'General case' 0 C--N 1.351 0.668 0 C-N-CA 123.974 0.909 . . . . 0.0 109.39 -176.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.418 ' SG ' ' HB2' ' A' ' 107' ' ' GLU . 23.4 p -77.11 162.87 27.12 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 172.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -59.87 -29.95 68.66 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 118.21 0.459 . . . . 0.0 111.881 -174.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.418 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 33.7 mt-10 -55.55 -52.3 64.18 Favored 'General case' 0 N--CA 1.481 1.101 0 O-C-N 123.986 0.804 . . . . 0.0 110.586 171.437 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.427 ' HB2' ' HB3' ' A' ' 104' ' ' PHE . 93.2 m -68.53 -39.59 81.1 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.278 178.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -63.43 -36.63 84.36 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.774 0.83 . . . . 0.0 111.115 -177.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -81.24 -22.36 38.79 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.71 0.804 . . . . 0.0 110.865 177.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -88.0 -7.75 56.61 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.838 0.855 . . . . 0.0 112.367 178.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 108' ' ' CYS . 84.0 mt . . . . . 0 N--CA 1.481 1.115 0 CA-C-O 118.712 -0.661 . . . . 0.0 110.42 176.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.2 tm? . . . . . 0 N--CA 1.488 1.452 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -172.59 129.49 0.54 Allowed 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.183 0.993 . . . . 0.0 109.509 177.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 177.8 67.25 0.06 OUTLIER Glycine 0 C--N 1.339 0.741 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -156.35 133.9 3.85 Favored Glycine 0 C--N 1.346 1.093 0 N-CA-C 112.04 -0.424 . . . . 0.0 112.04 -179.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -124.43 -62.27 1.27 Allowed 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.175 0.99 . . . . 0.0 110.096 -178.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.6 t -131.9 -61.23 0.89 Allowed 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.251 0.621 . . . . 0.0 109.738 -176.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 50.6 ttm -91.55 146.89 23.42 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 176.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -74.94 77.57 2.17 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-O 121.754 0.788 . . . . 0.0 110.329 177.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 49.2 t -77.58 -26.49 15.17 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-N 114.878 -1.056 . . . . 0.0 110.605 -177.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -67.06 -33.4 75.44 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.31 0.644 . . . . 0.0 110.759 178.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.8 m -61.94 -43.37 98.98 Favored 'General case' 0 C--O 1.243 0.732 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.378 172.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.449 ' HA ' HG22 ' A' ' 15' ' ' ILE . 22.6 m-85 -68.61 -37.97 80.19 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 114.941 -1.027 . . . . 0.0 110.585 177.414 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.488 ' HG2' HG21 ' A' ' 76' ' ' ILE . 2.5 tm-20 -56.47 -55.39 34.27 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 125.218 1.407 . . . . 0.0 110.302 -175.21 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.1 -45.03 78.46 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.79 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.457 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 12.5 tt -65.22 -31.63 54.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 CA-C-N 118.099 0.409 . . . . 0.0 110.847 -174.242 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.536 ' HB3' HG23 ' A' ' 69' ' ' ILE . 60.1 mt -64.57 -44.38 90.89 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.516 0.726 . . . . 0.0 110.449 174.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 53.1 mtt180 -63.44 -39.77 95.37 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 123.864 0.728 . . . . 0.0 111.357 177.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -65.93 -44.21 85.78 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.899 0.479 . . . . 0.0 110.473 -177.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.457 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -66.38 -43.58 85.5 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.893 178.276 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.65 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.0 pt20 -70.14 -29.41 66.32 Favored 'General case' 0 C--O 1.207 -1.171 0 CA-C-O 118.608 -0.711 . . . . 0.0 110.707 -177.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 87.5 mtt180 -74.93 -44.58 47.8 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.704 0.802 . . . . 0.0 112.114 -177.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -62.62 -43.37 98.99 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-O 121.371 0.605 . . . . 0.0 109.703 177.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.592 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 86.6 mt -70.59 -33.84 71.52 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 114.918 -1.037 . . . . 0.0 110.417 176.469 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.49 ' O ' ' HB2' ' A' ' 28' ' ' HIS . 0.2 OUTLIER -59.93 -56.62 19.42 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.285 0.634 . . . . 0.0 109.586 -177.917 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 20.4 ptt180 -64.62 -30.36 71.38 Favored 'General case' 0 N--CA 1.48 1.067 0 O-C-N 124.044 0.84 . . . . 0.0 110.895 -177.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -58.86 -57.75 11.68 Favored 'General case' 0 C--N 1.36 1.035 0 O-C-N 123.614 0.571 . . . . 0.0 111.359 175.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.618 ' HB2' ' HA ' ' A' ' 58' ' ' LEU . 2.2 pp -84.04 -25.32 29.96 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -174.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.49 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 3.5 m-70 -89.13 48.1 1.58 Allowed 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 123.845 0.858 . . . . 0.0 109.571 177.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.415 ' HA ' ' O ' ' A' ' 32' ' ' ALA . 9.7 ptpt -64.93 -23.75 67.32 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 125.01 1.324 . . . . 0.0 111.765 178.456 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.495 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -62.75 -36.32 74.84 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.096 0 C-N-CA 124.113 0.965 . . . . 0.0 112.246 178.402 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -101.67 -26.78 13.38 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.023 0.529 . . . . 0.0 110.514 178.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.415 ' O ' ' HA ' ' A' ' 29' ' ' LYS . . . -125.17 91.92 3.53 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.078 0.951 . . . . 0.0 110.298 -173.142 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -70.33 134.26 47.75 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 169.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -66.0 85.07 0.08 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.564 0.746 . . . . 0.0 110.326 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -101.15 -16.65 16.97 Favored 'General case' 0 C--O 1.241 0.652 0 C-N-CA 123.938 0.895 . . . . 0.0 110.215 179.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -73.99 138.27 76.12 Favored Pre-proline 0 CA--C 1.548 0.9 0 CA-C-N 115.309 -0.859 . . . . 0.0 109.586 178.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -61.2 160.55 26.21 Favored 'Trans proline' 0 C--N 1.378 2.12 0 C-N-CA 122.986 2.457 . . . . 0.0 112.484 175.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 15.3 mmm180 -72.61 -18.69 61.57 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.434 0.694 . . . . 0.0 111.252 175.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -69.66 153.22 95.83 Favored Pre-proline 0 CA--C 1.551 1.015 0 C-N-CA 123.495 0.718 . . . . 0.0 109.636 168.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -67.17 78.22 0.43 Allowed 'Trans proline' 0 C--N 1.377 2.033 0 C-N-CA 122.746 2.298 . . . . 0.0 111.874 175.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -110.28 35.62 3.36 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 124.324 1.049 . . . . 0.0 108.447 -177.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -75.37 80.07 2.44 Favored 'General case' 0 C--N 1.351 0.633 0 CA-C-N 114.61 -1.177 . . . . 0.0 109.148 178.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -82.44 -51.58 7.7 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-N 114.807 -1.088 . . . . 0.0 109.966 -178.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -164.34 123.43 1.9 Allowed 'General case' 0 C--O 1.239 0.537 0 CA-C-N 114.832 -1.076 . . . . 0.0 109.568 175.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 10.2 tpt180 -137.23 101.25 4.48 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 106.422 -1.695 . . . . 0.0 106.422 175.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.33 -31.25 63.56 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 124.37 1.068 . . . . 0.0 113.839 -166.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 78.3 p 48.04 36.92 6.94 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 125.156 1.382 . . . . 0.0 111.341 -172.298 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -68.75 -22.52 64.3 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 114.372 -1.285 . . . . 0.0 110.793 -176.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 52.6 mtp180 73.87 161.25 0.24 Allowed 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 125.581 1.553 . . . . 0.0 112.513 177.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 34.7 t -135.58 -112.25 0.2 Allowed 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 175.334 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -76.98 118.59 19.71 Favored 'General case' 0 C--N 1.354 0.765 0 CA-C-N 119.052 0.842 . . . . 0.0 109.249 171.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -125.25 86.69 2.58 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.584 0.707 . . . . 0.0 109.522 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -119.11 -170.39 1.91 Allowed 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.47 174.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 90.6 t -57.78 -59.33 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 123.443 0.697 . . . . 0.0 110.043 176.034 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.634 ' HB2' ' HG ' ' A' ' 58' ' ' LEU . 95.5 mt 58.31 124.51 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 125.793 1.637 . . . . 0.0 114.199 172.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -65.09 -20.18 66.35 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.334 0.654 . . . . 0.0 110.704 173.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -64.21 -30.36 71.42 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.022 1.329 . . . . 0.0 111.155 176.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.634 ' HG ' ' HB2' ' A' ' 55' ' ' LEU . 9.2 mt -81.3 141.46 34.04 Favored 'General case' 0 C--N 1.35 0.592 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 179.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -81.08 142.76 23.5 Favored Glycine 0 C--N 1.349 1.273 0 CA-C-O 119.292 -0.727 . . . . 0.0 112.039 177.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -55.41 -54.74 39.94 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 124.365 1.066 . . . . 0.0 112.014 -174.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.4 p -53.29 -41.24 42.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 123.701 0.8 . . . . 0.0 111.492 178.111 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.426 ' HA3' HD23 ' A' ' 27' ' ' LEU . . . -67.89 -41.64 87.68 Favored Glycine 0 C--O 1.215 -1.053 0 O-C-N 123.767 0.667 . . . . 0.0 113.049 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -66.75 -46.34 75.7 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.205 0.602 . . . . 0.0 111.01 -178.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -63.27 -37.3 86.69 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.837 0.855 . . . . 0.0 110.884 178.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -71.27 -45.03 64.1 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.141 -179.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.7 mp -62.27 -33.23 74.22 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.562 1.145 . . . . 0.0 110.932 176.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 73.3 ttt180 -67.95 -43.35 79.28 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.672 0.789 . . . . 0.0 110.339 176.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -67.62 -38.36 83.8 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.755 0.822 . . . . 0.0 111.273 179.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.65 HG21 ' HB3' ' A' ' 20' ' ' GLN . 96.6 mt -69.61 -41.67 80.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.858 0.863 . . . . 0.0 110.075 177.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -63.73 -38.56 91.55 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.673 0.789 . . . . 0.0 110.76 178.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.499 ' HB1' HH12 ' A' ' 75' ' ' ARG . . . -63.95 -42.91 97.17 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.867 0.867 . . . . 0.0 110.687 177.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.446 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -66.0 -51.32 59.41 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 114.913 -1.039 . . . . 0.0 111.102 179.1 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.522 HD23 HD12 ' A' ' 76' ' ' ILE . 82.1 mt -62.59 -36.72 83.61 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.427 1.091 . . . . 0.0 111.886 -179.214 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.81 -43.9 97.59 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.469 0.708 . . . . 0.0 110.244 175.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.499 HH12 ' HB1' ' A' ' 71' ' ' ALA . 80.7 mtt85 -73.51 -26.3 60.82 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 115.244 -0.889 . . . . 0.0 112.267 179.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.522 HD12 HD23 ' A' ' 73' ' ' LEU . 80.6 mt -69.76 -46.59 74.05 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 CA-C-N 118.473 0.579 . . . . 0.0 109.536 174.615 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.74 -36.59 83.52 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.867 178.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 30.2 t -81.09 -17.77 48.86 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 123.729 0.812 . . . . 0.0 111.433 177.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 81.6 10.3 84.55 Favored Glycine 0 C--N 1.35 1.35 0 C-N-CA 123.198 0.428 . . . . 0.0 113.893 178.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.8 t -106.89 21.33 17.7 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 124.415 1.086 . . . . 0.0 110.261 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -61.46 142.79 56.76 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 122.578 0.351 . . . . 0.0 110.335 173.065 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.516 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 82.5 20.72 61.49 Favored Glycine 0 C--O 1.218 -0.864 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.521 -175.234 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 26.4 m -113.11 110.43 20.43 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 117.524 0.662 . . . . 0.0 109.825 174.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.446 ' HB2' HD13 ' A' ' 91' ' ' ILE . 49.2 t -73.45 93.91 2.03 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 124.459 1.104 . . . . 0.0 109.857 172.239 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 34.1 m -63.85 -22.25 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.298 1.039 . . . . 0.0 112.751 -176.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.534 ' HD3' ' HB3' ' A' ' 108' ' ' CYS . 56.4 tttm -69.83 -24.44 63.46 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 122.675 0.39 . . . . 0.0 111.585 -178.288 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 29.0 p -127.59 11.16 6.74 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 122.626 0.37 . . . . 0.0 110.879 173.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 56.63 27.11 54.38 Favored Glycine 0 C--N 1.36 1.9 0 C-N-CA 123.869 0.747 . . . . 0.0 114.932 176.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -135.96 -176.7 4.39 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.983 0.913 . . . . 0.0 110.228 -174.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.516 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 12.8 tpp180 -68.77 152.29 45.52 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 124.585 1.154 . . . . 0.0 112.664 -172.041 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.446 HD13 ' HB2' ' A' ' 84' ' ' CYS . 3.1 mm -92.16 145.36 7.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 165.302 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 61.8 m -66.99 145.25 55.6 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 122.252 0.221 . . . . 0.0 110.561 176.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -61.47 -39.94 92.72 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.254 0.622 . . . . 0.0 110.42 177.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.436 ' HA ' ' HG2' ' A' ' 97' ' ' LYS . 16.1 m-20 -65.2 -35.69 81.84 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.863 0.865 . . . . 0.0 111.303 178.266 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -63.87 -44.12 94.03 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.07 176.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 96.3 mt -75.45 -36.49 60.7 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.364 0.666 . . . . 0.0 112.502 -176.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.436 ' HG2' ' HA ' ' A' ' 94' ' ' ASP . 16.6 ptpt -73.25 -28.81 62.35 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 120.528 0.204 . . . . 0.0 110.713 -176.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -80.48 -48.66 12.49 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 123.923 0.765 . . . . 0.0 110.299 174.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.1 p -144.72 99.96 4.72 Favored Pre-proline 0 CA--C 1.555 1.161 0 C-N-CA 124.231 1.012 . . . . 0.0 109.299 -178.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -78.47 -5.57 14.97 Favored 'Trans proline' 0 C--N 1.373 1.836 0 C-N-CA 122.531 2.154 . . . . 0.0 113.021 178.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 18.9 p90 -105.34 54.37 0.7 Allowed 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.718 0.807 . . . . 0.0 110.032 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.8 t -135.14 101.57 11.24 Favored Pre-proline 0 CA--C 1.554 1.099 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.639 172.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -59.8 -18.79 50.91 Favored 'Trans proline' 0 C--N 1.382 2.295 0 C-N-CA 123.245 2.63 . . . . 0.0 113.096 172.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -104.48 126.09 51.25 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.841 0.857 . . . . 0.0 109.859 -177.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 16.5 p -69.39 158.88 34.25 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 171.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 62.9 tp60 -48.13 -39.84 21.78 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 114.09 1.144 . . . . 0.0 114.09 -169.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -69.37 -34.0 73.92 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-N 117.943 0.338 . . . . 0.0 111.849 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.534 ' HB3' ' HD3' ' A' ' 86' ' ' LYS . 99.5 m -72.33 -38.85 68.55 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.331 0.652 . . . . 0.0 111.396 174.19 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.58 -33.25 75.47 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.826 0.85 . . . . 0.0 111.017 176.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.99 -31.38 58.95 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.016 0.926 . . . . 0.0 111.047 176.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -80.2 -10.64 59.77 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.726 0.81 . . . . 0.0 112.276 -178.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 95.4 mt . . . . . 0 C--O 1.252 1.201 0 CA-C-O 118.693 -0.67 . . . . 0.0 110.227 177.181 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.4 mp . . . . . 0 N--CA 1.481 1.118 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 62.07 98.41 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 124.695 1.198 . . . . 0.0 110.682 -178.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -67.92 81.68 0.18 Allowed Glycine 0 C--N 1.351 1.38 0 CA-C-N 116.303 -0.408 . . . . 0.0 112.121 177.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -78.46 73.75 2.18 Favored Glycine 0 C--N 1.35 1.349 0 C-N-CA 123.377 0.513 . . . . 0.0 112.669 -177.05 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -67.69 -34.23 76.49 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.63 0.772 . . . . 0.0 110.349 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 32.1 t -62.99 -53.11 59.04 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.625 1.17 . . . . 0.0 110.985 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 39.0 ttp -85.63 4.44 36.36 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.294 0.637 . . . . 0.0 110.965 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.0 m120 63.18 28.1 15.81 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 124.631 1.172 . . . . 0.0 111.817 173.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 86.2 t -50.98 -41.21 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.607 1.163 . . . . 0.0 112.106 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -64.21 -37.4 87.35 Favored 'General case' 0 N--CA 1.484 1.27 0 O-C-N 123.722 0.639 . . . . 0.0 111.499 -176.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 17.4 m -63.0 -42.5 99.86 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.556 0.742 . . . . 0.0 110.042 176.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.522 ' HA ' HG22 ' A' ' 15' ' ' ILE . 28.3 m-85 -72.25 -33.79 67.77 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-N 114.611 -1.177 . . . . 0.0 110.735 179.131 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -59.73 -52.53 65.11 Favored 'General case' 0 C--O 1.246 0.875 0 C-N-CA 125.082 1.353 . . . . 0.0 110.268 -175.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.05 -48.49 68.14 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.995 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.522 HG22 ' HA ' ' A' ' 12' ' ' TYR . 13.3 tt -64.66 -29.65 48.0 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.35 0 CA-C-N 118.197 0.453 . . . . 0.0 110.688 -173.031 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.511 ' HB3' HG23 ' A' ' 69' ' ' ILE . 45.5 mt -62.34 -50.53 71.23 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.205 0.602 . . . . 0.0 110.248 172.27 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 52.3 mtm180 -64.23 -28.52 69.79 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.488 -0.778 . . . . 0.0 112.441 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -80.98 -33.34 33.85 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.302 0.641 . . . . 0.0 110.351 -177.302 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.449 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -69.46 -42.6 74.67 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.021 172.698 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.656 ' HB3' HG21 ' A' ' 69' ' ' ILE . 1.4 pt20 -71.37 -22.59 61.87 Favored 'General case' 0 C--O 1.208 -1.083 0 CA-C-O 119.349 -0.358 . . . . 0.0 110.324 179.554 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 32.6 mtt180 -62.84 -60.01 4.07 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.188 0.595 . . . . 0.0 110.52 173.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -60.98 -34.22 74.44 Favored 'General case' 0 N--CA 1.48 1.051 0 O-C-N 123.933 0.771 . . . . 0.0 110.833 -178.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 86.5 mt -69.08 -51.87 34.22 Favored 'General case' 0 C--N 1.352 0.707 0 C-N-CA 122.984 0.514 . . . . 0.0 111.336 176.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -56.19 -39.6 72.66 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 123.552 0.741 . . . . 0.0 111.416 -173.017 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 18.1 ptt180 -78.02 -33.36 51.16 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 122.428 0.291 . . . . 0.0 111.2 178.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 25.2 ttm180 -65.1 -41.42 94.95 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.517 0.727 . . . . 0.0 111.361 177.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.465 HD21 HD22 ' A' ' 66' ' ' LEU . 4.3 pp -94.02 -28.58 15.68 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.799 0.44 . . . . 0.0 111.193 -172.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -91.35 33.4 0.99 Allowed 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 167.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 18.8 pttp -46.59 -42.73 16.47 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 125.933 1.693 . . . . 0.0 112.465 169.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.511 ' H ' HD13 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -62.48 -31.09 50.73 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.911 0 C-N-CA 124.34 1.056 . . . . 0.0 111.942 179.621 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -93.8 -21.04 19.54 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.653 0.781 . . . . 0.0 110.822 178.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -83.45 170.18 14.74 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.737 0.815 . . . . 0.0 110.493 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -84.43 30.53 0.54 Allowed 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 124.013 0.925 . . . . 0.0 111.862 -176.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 14.9 t80 60.44 95.91 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 124.895 1.278 . . . . 0.0 109.807 -174.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -61.18 -66.44 0.53 Allowed 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.467 0.707 . . . . 0.0 112.269 -168.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 60.92 108.5 0.03 OUTLIER Pre-proline 0 N--CA 1.483 1.186 0 C-N-CA 125.003 1.321 . . . . 0.0 110.921 -168.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -72.41 79.48 1.8 Allowed 'Trans proline' 0 C--N 1.377 2.035 0 C-N-CA 122.544 2.163 . . . . 0.0 111.304 179.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 25.3 mtp180 -63.36 -36.67 84.47 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.974 0.91 . . . . 0.0 110.06 179.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -143.83 138.58 15.29 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 124.915 1.286 . . . . 0.0 108.868 177.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -64.9 -24.87 60.38 Favored 'Trans proline' 0 C--N 1.38 2.219 0 C-N-CA 122.666 2.244 . . . . 0.0 111.586 174.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -86.58 133.81 33.69 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.348 1.059 . . . . 0.0 110.081 177.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.52 172.67 12.99 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.377 0.671 . . . . 0.0 110.792 171.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -90.12 75.17 7.09 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 173.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 26.8 t70 68.55 29.81 5.41 Favored 'General case' 0 CA--C 1.557 1.228 0 CA-C-N 114.23 -1.35 . . . . 0.0 110.269 178.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 35.6 ttp180 69.61 126.92 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 125.339 1.456 . . . . 0.0 111.605 -176.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -145.88 -176.43 5.14 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.085 0.554 . . . . 0.0 111.257 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 40.9 m 78.21 149.67 0.1 Allowed 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 126.279 1.831 . . . . 0.0 112.858 175.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.533 ' HG3' ' HD2' ' A' ' 49' ' ' ARG . 13.0 pt-20 -158.47 -131.2 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.051 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 173.414 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.533 ' HD2' ' HG3' ' A' ' 48' ' ' GLU . 8.3 mpt_? 66.29 80.48 0.22 Allowed 'General case' 0 C--N 1.361 1.084 0 C-N-CA 124.173 0.989 . . . . 0.0 110.057 179.003 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.6 p -83.75 70.83 10.42 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 114.848 -1.069 . . . . 0.0 109.931 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.546 ' HB3' ' HG2' ' A' ' 53' ' ' GLU . 2.1 m-20 -69.29 124.11 22.96 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 114.987 -1.006 . . . . 0.0 109.849 -178.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -107.45 38.6 2.1 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.607 0.763 . . . . 0.0 109.754 178.278 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.546 ' HG2' ' HB3' ' A' ' 51' ' ' ASN . 12.5 mm-40 -65.82 150.49 48.48 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.266 -0.879 . . . . 0.0 112.089 -175.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 38.6 t -67.51 -26.44 35.62 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 C-N-CA 124.218 1.007 . . . . 0.0 110.594 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 32.1 tp -58.75 111.67 1.36 Allowed 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 123.407 0.683 . . . . 0.0 110.77 178.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -98.34 48.39 0.99 Allowed 'General case' 0 CA--C 1.554 1.103 0 CA-C-O 122.452 1.12 . . . . 0.0 109.121 -175.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -93.3 26.03 3.1 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 124.964 1.306 . . . . 0.0 109.871 173.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.409 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 7.8 mt -103.26 147.26 27.27 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.18 0.992 . . . . 0.0 109.035 -170.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -64.65 145.01 49.11 Favored Glycine 0 N--CA 1.477 1.387 0 CA-C-O 119.592 -0.56 . . . . 0.0 113.27 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -64.07 -60.35 3.34 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.699 0.8 . . . . 0.0 111.719 -174.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.2 t -58.89 -32.34 47.03 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 123.881 0.872 . . . . 0.0 110.2 177.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.514 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -59.66 -51.77 57.02 Favored Glycine 0 C--N 1.353 1.511 0 O-C-N 124.051 0.844 . . . . 0.0 112.624 174.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -72.27 -36.66 69.07 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 124.098 0.959 . . . . 0.0 112.339 -175.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -73.28 -38.77 65.79 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.413 0.685 . . . . 0.0 110.369 -176.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -71.22 -37.05 72.05 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.627 174.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' A' ' 62' ' ' GLY . 6.2 tp -58.62 -45.95 88.13 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 124.606 1.162 . . . . 0.0 109.568 177.209 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 47.4 ttt180 -64.84 -38.84 92.31 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.481 1.112 . . . . 0.0 110.5 -178.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.52 -36.64 83.2 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.914 177.015 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.656 HG21 ' HB3' ' A' ' 20' ' ' GLN . 95.0 mt -69.86 -49.79 54.24 Favored 'Isoleucine or valine' 0 C--N 1.356 0.86 0 C-N-CA 123.594 0.758 . . . . 0.0 110.83 178.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 52.6 m-20 -65.18 -35.64 81.71 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.753 0.821 . . . . 0.0 111.151 -177.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.432 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -64.88 -45.5 85.73 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.312 0.645 . . . . 0.0 109.96 175.028 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.412 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -67.15 -34.91 78.58 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.993 0.917 . . . . 0.0 111.709 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.47 HD23 HD12 ' A' ' 76' ' ' ILE . 71.9 mt -72.75 -32.33 65.59 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.857 0.863 . . . . 0.0 110.821 177.099 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.57 -27.64 63.29 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.875 0.87 . . . . 0.0 110.785 174.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.432 ' HG2' ' O ' ' A' ' 71' ' ' ALA . 5.7 mmp_? -69.06 -42.48 76.2 Favored 'General case' 0 C--N 1.353 0.75 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 172.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.47 HD12 HD23 ' A' ' 73' ' ' LEU . 71.1 mt -64.68 -41.36 92.0 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 C-N-CA 123.206 0.602 . . . . 0.0 110.367 177.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -59.37 -38.81 81.39 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.027 0.931 . . . . 0.0 111.292 178.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.535 ' HB3' HG22 ' A' ' 80' ' ' THR . 35.5 t -87.05 -13.9 43.04 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 115.027 -0.988 . . . . 0.0 111.226 178.279 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 78.75 8.15 87.88 Favored Glycine 0 C--N 1.348 1.25 0 C-N-CA 123.177 0.417 . . . . 0.0 113.441 -176.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.535 HG22 ' HB3' ' A' ' 78' ' ' SER . 13.5 t -101.4 24.58 9.41 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.708 1.203 . . . . 0.0 110.065 -178.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -61.89 152.87 30.66 Favored 'General case' 0 C--N 1.35 0.595 0 C-N-CA 123.222 0.609 . . . . 0.0 110.351 170.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.53 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 70.39 21.39 77.42 Favored Glycine 0 C--N 1.344 0.984 0 CA-C-N 115.639 -0.71 . . . . 0.0 112.476 -176.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 30.9 m -118.23 113.89 22.19 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.471 0.709 . . . . 0.0 109.69 178.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 52.7 t -72.93 90.12 1.45 Allowed 'General case' 0 C--O 1.238 0.472 0 C-N-CA 123.438 0.695 . . . . 0.0 109.517 171.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 29.5 m -61.22 -23.03 28.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 124.411 1.084 . . . . 0.0 112.756 -176.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.401 ' HD3' ' HB3' ' A' ' 108' ' ' CYS . 54.5 tttm -64.71 -27.2 68.75 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.305 0.642 . . . . 0.0 111.588 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.442 ' SG ' ' HB2' ' A' ' 89' ' ' LYS . 30.7 p -136.14 4.12 2.94 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 112.038 0.384 . . . . 0.0 112.038 -179.252 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 63.06 30.89 78.87 Favored Glycine 0 C--N 1.349 1.264 0 O-C-N 123.128 0.267 . . . . 0.0 113.723 -178.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.442 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 11.5 mmmm -106.88 172.08 7.01 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.806 0.842 . . . . 0.0 110.462 -179.568 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.53 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 15.2 tpp180 -90.92 128.4 36.76 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.126 0.97 . . . . 0.0 109.651 177.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 9.2 mm -64.91 142.4 16.97 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 171.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 19.6 m -74.26 150.72 40.11 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 122.847 0.459 . . . . 0.0 109.774 177.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -61.96 -37.14 83.64 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 122.919 0.488 . . . . 0.0 110.287 175.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -62.17 -45.87 91.46 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 124.115 0.966 . . . . 0.0 110.755 176.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.442 ' HG3' HG21 ' A' ' 102' ' ' THR . 28.3 tpt180 -60.85 -40.62 93.57 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.405 175.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 82.0 mt -69.75 -38.45 76.81 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.508 0.723 . . . . 0.0 112.184 -178.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -79.18 -30.95 43.69 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 122.372 0.269 . . . . 0.0 110.42 -174.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -80.06 -39.28 30.08 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.806 0.842 . . . . 0.0 110.641 177.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.5 p -148.48 92.3 4.54 Favored Pre-proline 0 CA--C 1.556 1.196 0 C-N-CA 124.33 1.052 . . . . 0.0 109.49 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.06 -17.3 31.82 Favored 'Trans proline' 0 C--N 1.378 2.086 0 C-N-CA 122.404 2.069 . . . . 0.0 112.346 175.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 10.7 p90 -94.6 62.71 2.82 Favored 'General case' 0 C--N 1.348 0.525 0 C-N-CA 124.333 1.053 . . . . 0.0 109.092 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.442 HG21 ' HG3' ' A' ' 95' ' ' ARG . 12.4 t -137.54 117.08 10.19 Favored Pre-proline 0 CA--C 1.553 1.089 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.511 178.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -81.23 -7.29 12.98 Favored 'Trans proline' 0 C--N 1.368 1.568 0 C-N-CA 122.259 1.972 . . . . 0.0 111.877 169.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -116.97 143.97 45.11 Favored 'General case' 0 C--N 1.356 0.858 0 C-N-CA 123.465 0.706 . . . . 0.0 110.162 -175.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 30.6 p -80.89 164.25 22.77 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 174.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -51.31 -37.77 49.34 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.791 0.837 . . . . 0.0 111.705 -178.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -54.88 -53.59 53.48 Favored 'General case' 0 CA--C 1.55 0.957 0 O-C-N 124.378 1.049 . . . . 0.0 110.74 175.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.401 ' HB3' ' HD3' ' A' ' 86' ' ' LYS . 87.8 m -71.35 -34.24 70.33 Favored 'General case' 0 N--CA 1.482 1.141 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.68 -176.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -63.28 -38.85 92.75 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.718 0.807 . . . . 0.0 110.546 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -77.34 -25.94 51.57 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.802 0.841 . . . . 0.0 111.108 176.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -106.17 22.81 15.09 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 123.898 0.879 . . . . 0.0 111.976 -176.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 73.0 mt . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 119.028 -0.511 . . . . 0.0 110.004 173.04 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 4.5 mp . . . . . 0 N--CA 1.493 1.68 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 57.43 86.78 0.07 Allowed 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.86 1.264 . . . . 0.0 112.949 171.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -67.73 -44.99 78.93 Favored Glycine 0 C--N 1.347 1.15 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.763 179.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -107.3 85.99 0.44 Allowed Glycine 0 C--N 1.338 0.664 0 N-CA-C 111.344 -0.702 . . . . 0.0 111.344 178.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -156.49 -71.65 0.1 Allowed 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.286 0.634 . . . . 0.0 110.956 178.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.636 ' HB2' ' HB2' ' A' ' 93' ' ' GLU . 59.6 p -100.98 62.67 0.99 Allowed 'General case' 0 C--O 1.245 0.86 0 C-N-CA 123.743 0.817 . . . . 0.0 110.963 -171.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 39.1 ttm -167.68 96.16 0.45 Allowed 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.188 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -89.32 84.09 6.45 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 171.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 90.6 t -54.92 -41.81 60.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 CA-C-N 114.675 -1.148 . . . . 0.0 111.966 -172.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -61.07 -39.22 89.07 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.708 0.803 . . . . 0.0 111.732 -177.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 17.7 m -62.5 -42.2 99.34 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.379 0.672 . . . . 0.0 110.013 177.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.475 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 26.4 m-85 -71.6 -33.02 68.64 Favored 'General case' 0 C--O 1.213 -0.844 0 CA-C-N 114.558 -1.201 . . . . 0.0 110.788 179.066 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -67.42 -53.13 31.75 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 124.047 0.939 . . . . 0.0 110.523 -175.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -63.13 -43.32 98.69 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.416 -179.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.495 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 13.7 tt -65.24 -33.4 63.42 Favored 'Isoleucine or valine' 0 C--N 1.363 1.16 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 -177.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.531 ' HB3' HG23 ' A' ' 69' ' ' ILE . 61.2 mt -67.17 -36.82 82.61 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.127 0.571 . . . . 0.0 111.402 177.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 19.8 mtm180 -63.79 -41.49 97.92 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 123.279 0.362 . . . . 0.0 110.856 176.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -69.78 -40.25 76.15 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.028 0.531 . . . . 0.0 111.468 -179.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.495 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -63.99 -50.34 68.92 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.442 0.697 . . . . 0.0 110.276 178.621 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.614 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.9 pt20 -64.71 -31.56 72.83 Favored 'General case' 0 C--O 1.213 -0.864 0 CA-C-O 119.248 -0.406 . . . . 0.0 110.494 -178.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 29.6 mtt85 -68.68 -51.03 46.2 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.43 0.692 . . . . 0.0 112.129 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -61.37 -35.1 76.53 Favored 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 178.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.535 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 95.6 mt -67.0 -45.47 77.51 Favored 'General case' 0 C--O 1.215 -0.75 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.674 173.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.483 ' HB3' ' HG3' ' A' ' 48' ' ' GLU . 1.8 m-85 -60.62 -47.24 87.1 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.883 0.873 . . . . 0.0 111.954 -173.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.448 ' HD3' ' HG2' ' A' ' 35' ' ' GLU . 9.0 ptp180 -66.72 -35.43 80.11 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 122.637 0.375 . . . . 0.0 110.273 176.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.426 ' O ' ' HE3' ' A' ' 29' ' ' LYS . 37.1 ttm180 -63.5 -43.63 96.69 Favored 'General case' 0 C--N 1.362 1.11 0 C-N-CA 123.709 0.804 . . . . 0.0 112.031 178.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 2.7 pp -86.09 -21.23 27.76 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 122.977 0.511 . . . . 0.0 111.319 -176.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 57.6 m-70 -90.3 26.64 1.87 Allowed 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 171.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.426 ' HE3' ' O ' ' A' ' 26' ' ' ARG . 9.7 ptpp? -48.35 -30.14 4.64 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 126.21 1.804 . . . . 0.0 113.942 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.47 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -62.39 -26.4 40.3 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 124.38 1.072 . . . . 0.0 112.344 -177.689 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -122.38 -35.96 3.03 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.639 0.776 . . . . 0.0 111.087 -178.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -79.75 94.19 5.71 Favored 'General case' 0 C--N 1.348 0.505 0 C-N-CA 123.897 0.879 . . . . 0.0 109.555 -177.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -121.75 -39.09 2.66 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.734 1.214 . . . . 0.0 108.335 176.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -105.66 77.08 1.24 Allowed 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.657 178.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.448 ' HG2' ' HD3' ' A' ' 25' ' ' ARG . 5.9 mp0 -70.62 -65.02 0.79 Allowed 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 106.861 -1.533 . . . . 0.0 106.861 167.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -117.72 154.99 51.13 Favored Pre-proline 0 CA--C 1.539 0.554 0 CA-C-N 114.448 -1.251 . . . . 0.0 109.008 178.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -52.67 -61.81 0.44 Allowed 'Trans proline' 0 C--N 1.38 2.201 0 C-N-CA 122.947 2.431 . . . . 0.0 112.518 175.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.2 ptt180 -168.15 58.28 0.06 Allowed 'General case' 0 N--CA 1.48 1.027 0 CA-C-O 122.269 1.033 . . . . 0.0 109.232 174.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -91.37 143.21 27.87 Favored Pre-proline 0 N--CA 1.478 0.928 0 CA-C-N 114.876 -1.056 . . . . 0.0 111.268 -175.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -61.84 137.7 69.53 Favored 'Trans proline' 0 C--N 1.38 2.209 0 C-N-CA 122.858 2.372 . . . . 0.0 110.994 171.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -56.82 100.76 0.05 OUTLIER 'General case' 0 N--CA 1.485 1.281 0 O-C-N 123.978 0.799 . . . . 0.0 110.043 175.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -148.58 -69.75 0.22 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.486 0.714 . . . . 0.0 109.467 -170.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -93.22 -58.24 2.37 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 49.8 50.5 18.27 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 125.26 1.424 . . . . 0.0 110.157 178.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -59.22 -62.33 1.96 Allowed 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.487 -172.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 62.4 -177.73 0.13 Allowed 'General case' 0 N--CA 1.477 0.891 0 O-C-N 124.524 1.14 . . . . 0.0 112.624 -177.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 28.1 t -158.47 35.74 0.23 Allowed 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 177.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.483 ' HG3' ' HB3' ' A' ' 24' ' ' TYR . 0.7 OUTLIER -61.62 150.1 37.32 Favored 'General case' 0 C--N 1.353 0.725 0 CA-C-N 114.695 -1.139 . . . . 0.0 111.996 -173.375 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -66.52 89.62 0.15 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 124.54 1.136 . . . . 0.0 110.971 -178.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 37.1 p -78.91 135.78 37.08 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.714 176.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 59.28 82.43 0.15 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.855 1.262 . . . . 0.0 110.081 -175.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -144.99 87.46 1.83 Allowed 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 114.855 -1.066 . . . . 0.0 108.153 -174.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 59.79 177.71 0.09 Allowed 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 125.124 1.37 . . . . 0.0 113.13 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 95.2 t -77.22 -59.98 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 174.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 32.6 tp 53.63 109.77 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 125.771 1.628 . . . . 0.0 112.816 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -62.09 -24.6 67.22 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 123.183 0.593 . . . . 0.0 111.773 178.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -74.85 1.71 11.98 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.509 0.724 . . . . 0.0 112.442 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.487 HD13 HD13 ' A' ' 27' ' ' LEU . 19.1 mt -76.11 -63.67 1.27 Allowed 'General case' 0 C--N 1.354 0.785 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 171.738 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 119.82 146.1 7.66 Favored Glycine 0 N--CA 1.475 1.278 0 CA-C-O 119.253 -0.749 . . . . 0.0 111.651 177.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 60.3 tt0 -58.08 -50.9 71.84 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.047 0.939 . . . . 0.0 111.892 -173.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 7.1 p -54.74 -38.79 44.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 123.71 0.804 . . . . 0.0 111.402 179.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -71.3 -53.5 10.3 Favored Glycine 0 C--N 1.346 1.124 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.797 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -65.46 -38.11 88.86 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 124.249 1.02 . . . . 0.0 111.534 -175.065 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -69.13 -43.29 74.68 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.889 0.876 . . . . 0.0 110.252 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -70.41 -35.64 73.55 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.577 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.3 mp -63.15 -39.59 95.1 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.215 1.006 . . . . 0.0 110.792 175.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 52.6 ttt180 -59.89 -45.7 91.7 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.932 0.893 . . . . 0.0 110.026 175.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.519 ' HB1' ' O ' ' A' ' 101' ' ' TYR . . . -64.87 -44.79 88.53 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 114.713 -1.131 . . . . 0.0 111.922 -178.272 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.614 HG21 ' HB3' ' A' ' 20' ' ' GLN . 83.3 mt -70.74 -44.64 76.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 123.581 0.752 . . . . 0.0 110.81 -178.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -68.2 -37.48 80.95 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.365 0.666 . . . . 0.0 110.835 -175.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.464 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -64.93 -43.08 93.95 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.795 0.684 . . . . 0.0 110.232 176.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.43 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -62.09 -45.5 93.22 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 123.884 0.74 . . . . 0.0 110.996 177.649 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.541 HD23 HD12 ' A' ' 76' ' ' ILE . 86.2 mt -63.31 -34.92 78.73 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 124.263 1.025 . . . . 0.0 111.589 176.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.44 -35.92 81.51 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.464 0.706 . . . . 0.0 110.711 177.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.464 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 52.6 mtp85 -72.77 -29.09 63.01 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.987 176.511 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.541 HD12 HD23 ' A' ' 73' ' ' LEU . 84.0 mt -66.99 -44.08 88.68 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 122.574 0.35 . . . . 0.0 110.084 176.252 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.1 -35.23 80.48 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.521 0.729 . . . . 0.0 111.119 177.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.417 ' HB3' HG22 ' A' ' 80' ' ' THR . 32.4 t -79.64 -19.8 48.28 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 123.604 0.762 . . . . 0.0 111.358 177.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 80.58 12.1 83.31 Favored Glycine 0 C--N 1.351 1.365 0 C-N-CA 123.034 0.349 . . . . 0.0 113.6 -178.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.417 HG22 ' HB3' ' A' ' 78' ' ' SER . 10.2 t -110.28 21.54 16.59 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 124.279 1.032 . . . . 0.0 110.781 179.558 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 75.6 t80 -60.14 145.26 47.51 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.118 0.567 . . . . 0.0 111.595 171.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 75.11 38.53 39.83 Favored Glycine 0 C--N 1.348 1.247 0 O-C-N 124.016 0.823 . . . . 0.0 111.926 -176.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 40.5 m -127.78 117.9 22.73 Favored 'General case' 0 C--O 1.243 0.731 0 C-N-CA 124.014 0.926 . . . . 0.0 109.16 175.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 51.2 t -61.49 102.7 0.26 Allowed 'General case' 0 C--N 1.351 0.649 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 169.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 23.1 m -56.69 -38.42 57.73 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 C-N-CA 124.312 1.045 . . . . 0.0 111.562 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -68.77 -21.65 64.34 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.07 0.948 . . . . 0.0 111.361 -177.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 59.9 m -105.24 -29.65 10.18 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.398 0.679 . . . . 0.0 111.962 178.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 66.34 32.08 80.89 Favored Glycine 0 CA--C 1.536 1.35 0 N-CA-C 111.624 -0.59 . . . . 0.0 111.624 -161.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -130.73 -178.44 4.8 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.971 0.909 . . . . 0.0 110.999 -174.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 25.8 mmm180 -71.99 159.95 33.35 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.832 0.853 . . . . 0.0 113.17 -175.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 39.2 mm -106.93 147.0 12.62 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 CA-C-N 114.521 -1.218 . . . . 0.0 108.196 163.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 13.2 m -73.97 149.78 41.14 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.418 0.687 . . . . 0.0 110.252 178.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.636 ' HB2' ' HB2' ' A' ' 6' ' ' SER . 32.2 tt0 -58.8 -45.16 90.56 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.48 0.712 . . . . 0.0 110.23 175.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.403 ' HA ' ' HE3' ' A' ' 97' ' ' LYS . 38.0 m-20 -65.32 -31.87 73.23 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.457 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.535 ' HE ' ' HA ' ' A' ' 95' ' ' ARG . 2.1 tpm_? -70.79 -40.75 72.37 Favored 'General case' 0 C--O 1.216 -0.687 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.095 175.278 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 79.5 mt -70.63 -39.53 73.63 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.377 0.671 . . . . 0.0 111.723 -178.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.403 ' HE3' ' HA ' ' A' ' 94' ' ' ASP . 16.0 ptpt -71.81 -31.88 67.01 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 122.684 0.394 . . . . 0.0 110.312 -176.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -77.17 -58.24 3.39 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.073 0.549 . . . . 0.0 110.386 174.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.6 p -130.98 95.2 26.06 Favored Pre-proline 0 CA--C 1.562 1.427 0 C-N-CA 124.81 1.244 . . . . 0.0 109.857 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -80.14 -11.66 13.37 Favored 'Trans proline' 0 C--N 1.378 2.106 0 C-N-CA 122.71 2.273 . . . . 0.0 112.929 177.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . 0.519 ' O ' ' HB1' ' A' ' 68' ' ' ALA . 10.2 p90 -95.74 36.29 1.3 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.329 0.651 . . . . 0.0 111.069 179.678 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 15.0 t -106.78 120.26 48.79 Favored Pre-proline 0 CA--C 1.555 1.159 0 O-C-N 122.088 -0.382 . . . . 0.0 110.506 177.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -78.41 -9.37 16.22 Favored 'Trans proline' 0 C--N 1.376 2.013 0 C-N-CA 122.361 2.04 . . . . 0.0 112.097 168.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.437 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 14.9 m-85 -118.13 159.04 23.96 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.043 0.537 . . . . 0.0 110.465 -174.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 31.1 p -85.81 169.5 13.3 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 174.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.495 ' HB2' ' HD2' ' A' ' 95' ' ' ARG . 36.1 tt0 -59.32 -28.39 66.77 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 122.985 0.514 . . . . 0.0 111.439 -176.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -70.04 -47.17 63.14 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.319 1.048 . . . . 0.0 109.851 -178.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.437 ' HB2' ' HB3' ' A' ' 104' ' ' PHE . 94.0 m -68.44 -36.08 78.52 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.1 175.37 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -62.8 -36.58 83.61 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.161 0.985 . . . . 0.0 111.058 178.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.29 -33.74 70.01 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.575 174.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -80.23 -10.07 59.75 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 123.67 0.788 . . . . 0.0 112.84 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 82.2 mt . . . . . 0 C--O 1.254 1.339 0 C-N-CA 123.089 0.556 . . . . 0.0 110.984 -179.147 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 55.6 tp . . . . . 0 N--CA 1.473 0.688 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 68.01 -71.97 0.1 Allowed 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 125.472 1.509 . . . . 0.0 111.408 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.426 ' HA2' ' HB2' ' A' ' 10' ' ' GLU . . . 72.1 -77.88 0.68 Allowed Glycine 0 C--N 1.357 1.698 0 C-N-CA 123.433 0.539 . . . . 0.0 113.177 175.028 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -132.64 63.4 0.62 Allowed Glycine 0 C--N 1.34 0.783 0 N-CA-C 110.272 -1.131 . . . . 0.0 110.272 175.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.2 ttpp -74.52 -60.8 2.11 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-O 121.42 0.628 . . . . 0.0 110.66 -174.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 30.4 t -142.64 14.26 1.95 Allowed 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.987 0.915 . . . . 0.0 109.442 176.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . 0.443 ' HB3' ' HE2' ' A' ' 7' ' ' MET . 22.1 ptp -175.51 173.12 2.51 Favored 'General case' 0 C--O 1.241 0.637 0 C-N-CA 125.767 1.627 . . . . 0.0 107.582 -175.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -79.68 70.86 6.26 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 176.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 22.8 t -63.33 -37.68 80.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.959 -173.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.426 ' HB2' ' HA2' ' A' ' 3' ' ' GLY . 42.4 tt0 -58.47 -41.16 84.62 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 124.192 0.933 . . . . 0.0 110.845 -178.592 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.3 m -58.54 -47.24 84.87 Favored 'General case' 0 C--N 1.351 0.654 0 O-C-N 124.097 0.873 . . . . 0.0 110.611 176.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.413 ' HA ' HG22 ' A' ' 15' ' ' ILE . 51.8 m-85 -67.87 -37.72 82.16 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 124.335 1.022 . . . . 0.0 111.361 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.456 ' O ' ' HG3' ' A' ' 17' ' ' ARG . 2.4 tm-20 -60.97 -56.49 20.45 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.29 1.036 . . . . 0.0 110.145 -176.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -72.13 -35.65 69.18 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.048 -175.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.445 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 11.4 tt -66.72 -33.9 66.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 CA-C-N 118.368 0.531 . . . . 0.0 110.128 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.481 ' HB3' HG23 ' A' ' 69' ' ' ILE . 64.0 mt -67.48 -38.32 84.2 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 122.964 0.506 . . . . 0.0 110.557 174.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.5 ' O ' ' HG2' ' A' ' 21' ' ' ARG . 15.5 mtm180 -64.79 -46.05 83.67 Favored 'General case' 0 C--N 1.353 0.732 0 O-C-N 123.314 0.384 . . . . 0.0 110.29 176.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.78 -46.76 88.15 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.527 0.731 . . . . 0.0 111.058 -177.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.445 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -65.74 -41.11 92.55 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.637 178.933 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.708 ' HB3' HG21 ' A' ' 69' ' ' ILE . 1.4 pt20 -67.12 -36.86 82.81 Favored 'General case' 0 C--O 1.206 -1.207 0 CA-C-O 118.937 -0.554 . . . . 0.0 110.091 -179.444 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.5 ' HG2' ' O ' ' A' ' 17' ' ' ARG . 4.2 mmp_? -61.12 -50.37 73.49 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 118.18 0.445 . . . . 0.0 110.899 -178.056 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -64.64 -33.37 75.77 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 123.511 0.507 . . . . 0.0 111.461 177.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.549 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 77.6 mt -77.35 -31.89 54.73 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 122.967 0.507 . . . . 0.0 112.105 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.439 ' HD1' ' O ' ' A' ' 20' ' ' GLN . 3.6 m-85 -65.51 -48.58 72.04 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -179.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 20.6 ptt180 -73.02 -26.11 61.2 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.137 178.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 38.4 ttm-85 -59.1 -56.86 16.73 Favored 'General case' 0 C--N 1.36 1.059 0 C-N-CA 123.234 0.614 . . . . 0.0 110.513 173.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 2.4 pp -82.05 -24.63 35.2 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -173.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 -89.49 27.23 1.51 Allowed 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 123.243 0.617 . . . . 0.0 109.892 171.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.456 ' HZ2' ' HA ' ' A' ' 27' ' ' LEU . 9.8 ptpp? -42.74 -34.11 0.86 Allowed 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 126.541 1.936 . . . . 0.0 114.235 174.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.535 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -68.1 -28.98 43.05 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 C-N-CA 124.195 0.998 . . . . 0.0 112.845 -176.835 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -105.68 -24.91 12.44 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 123.557 0.743 . . . . 0.0 110.542 175.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -92.34 97.63 10.99 Favored 'General case' 0 C--O 1.243 0.751 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -179.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -59.05 128.1 35.52 Favored 'General case' 0 C--O 1.243 0.736 0 O-C-N 124.041 0.838 . . . . 0.0 110.784 -179.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -66.54 81.36 0.1 Allowed 'General case' 0 N--CA 1.472 0.634 0 O-C-N 124.148 0.905 . . . . 0.0 110.159 172.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -93.05 -23.05 18.78 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 114.848 -1.069 . . . . 0.0 109.534 175.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 57.28 81.76 0.25 Allowed Pre-proline 0 C--N 1.356 0.872 0 C-N-CA 124.301 1.04 . . . . 0.0 108.959 -170.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -56.2 93.46 0.05 OUTLIER 'Trans proline' 0 C--N 1.381 2.251 0 C-N-CA 122.986 2.457 . . . . 0.0 112.748 -176.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 33.4 mmt180 -77.33 -14.98 59.62 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.037 173.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -95.43 142.97 25.33 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 124.797 1.239 . . . . 0.0 108.566 172.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -78.84 9.89 3.1 Favored 'Trans proline' 0 C--N 1.377 2.061 0 C-N-CA 123.083 2.522 . . . . 0.0 113.803 -178.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -67.16 -15.65 63.83 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.964 1.306 . . . . 0.0 112.128 -179.395 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.413 ' HA ' ' HD3' ' A' ' 45' ' ' ARG . 7.7 p-10 -65.41 -13.55 58.92 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.185 0.994 . . . . 0.0 112.393 178.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -52.71 -48.17 66.82 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.594 1.158 . . . . 0.0 111.086 172.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -75.56 -17.26 60.11 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 114.592 -1.185 . . . . 0.0 111.818 -176.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.413 ' HD3' ' HA ' ' A' ' 42' ' ' ASP . 9.7 mpt_? -75.24 81.28 2.36 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.465 0.706 . . . . 0.0 109.355 176.096 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -103.88 96.81 6.94 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-N 114.887 -1.051 . . . . 0.0 109.228 177.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.5 m -66.49 89.62 0.15 Allowed 'General case' 0 CA--C 1.547 0.856 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.629 174.447 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -87.17 154.46 20.71 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.584 0.754 . . . . 0.0 109.021 178.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? 61.85 105.67 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.22 0 O-C-N 124.083 0.864 . . . . 0.0 109.672 -165.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.6 m -61.07 -84.08 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 123.458 0.703 . . . . 0.0 111.438 -175.395 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 167.88 135.33 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 126.231 1.813 . . . . 0.0 107.243 -174.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -88.03 -31.75 19.14 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-O 121.253 0.549 . . . . 0.0 110.261 -177.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -72.99 150.27 42.6 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 114.897 -1.047 . . . . 0.0 108.951 -179.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 22.0 t -64.33 -51.76 64.27 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 175.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.5 tp 60.31 103.32 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 125.151 1.38 . . . . 0.0 111.976 172.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -65.05 -20.4 66.47 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.586 0.754 . . . . 0.0 111.733 -177.044 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -66.42 -14.73 62.58 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 124.2 1.0 . . . . 0.0 112.357 179.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.505 HD22 HD13 ' A' ' 27' ' ' LEU . 79.1 mt -79.02 -69.67 0.56 Allowed 'General case' 0 C--N 1.35 0.618 0 C-N-CA 122.918 0.487 . . . . 0.0 111.857 -177.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 119.61 124.84 3.28 Favored Glycine 0 N--CA 1.472 1.096 0 N-CA-C 110.641 -0.984 . . . . 0.0 110.641 -175.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -58.65 -49.71 76.52 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 124.389 1.076 . . . . 0.0 112.734 -167.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.433 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 8.4 p -57.1 -42.74 80.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 O-C-N 124.004 0.815 . . . . 0.0 111.545 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.41 -38.63 70.07 Favored Glycine 0 C--N 1.348 1.199 0 O-C-N 123.82 0.7 . . . . 0.0 112.822 -177.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -63.75 -48.47 76.85 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.615 0.766 . . . . 0.0 111.488 -178.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -72.14 -23.57 61.32 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.869 179.415 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 61' ' ' VAL . 12.8 tt0 -74.97 -39.26 61.39 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 176.302 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.441 HD22 HD21 ' A' ' 27' ' ' LEU . 7.2 mp -63.67 -43.14 97.57 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.841 0.856 . . . . 0.0 110.153 173.171 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -60.5 -39.68 88.6 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 123.68 0.612 . . . . 0.0 109.881 179.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.12 -38.57 75.61 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.901 0.88 . . . . 0.0 111.636 178.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.708 HG21 ' HB3' ' A' ' 20' ' ' GLN . 78.5 mt -69.88 -57.61 7.76 Favored 'Isoleucine or valine' 0 C--N 1.363 1.153 0 C-N-CA 123.172 0.589 . . . . 0.0 110.765 -179.216 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -62.71 -28.95 70.3 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.368 1.067 . . . . 0.0 111.739 -178.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.445 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -69.05 -44.16 73.2 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 122.705 0.402 . . . . 0.0 110.037 172.206 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -66.11 -32.32 73.71 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.817 0.847 . . . . 0.0 111.274 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 90.4 mt -70.7 -37.31 73.57 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.963 0.905 . . . . 0.0 110.254 174.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.57 -26.91 65.64 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.758 0.823 . . . . 0.0 111.229 174.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.445 ' HG2' ' O ' ' A' ' 71' ' ' ALA . 5.7 mmp_? -70.32 -40.2 74.32 Favored 'General case' 0 C--N 1.357 0.908 0 C-N-CA 122.997 0.519 . . . . 0.0 109.799 173.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 81.8 mt -66.12 -43.42 92.21 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.243 0 C-N-CA 123.397 0.679 . . . . 0.0 110.292 178.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.29 -39.88 94.41 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.261 1.025 . . . . 0.0 110.775 178.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.427 ' HB3' HG22 ' A' ' 80' ' ' THR . 47.1 t -77.13 -24.73 51.62 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.677 0.791 . . . . 0.0 111.299 177.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 86.82 13.42 66.95 Favored Glycine 0 C--N 1.347 1.177 0 C-N-CA 123.169 0.414 . . . . 0.0 113.045 -176.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.427 HG22 ' HB3' ' A' ' 78' ' ' SER . 14.8 t -110.84 24.38 13.01 Favored 'General case' 0 CA--C 1.557 1.215 0 C-N-CA 124.329 1.051 . . . . 0.0 110.825 -179.087 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -70.95 142.92 51.03 Favored 'General case' 0 N--CA 1.477 0.913 0 O-C-N 121.977 -0.452 . . . . 0.0 109.95 168.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 77.29 26.97 60.56 Favored Glycine 0 C--N 1.346 1.098 0 O-C-N 123.903 0.752 . . . . 0.0 111.741 -173.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 49.3 m -122.77 119.71 31.42 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 124.142 0.977 . . . . 0.0 110.028 177.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 29.5 t -63.07 94.06 0.07 Allowed 'General case' 0 C--N 1.349 0.572 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 166.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 34.8 m -64.98 -25.73 38.4 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 C-N-CA 124.146 0.978 . . . . 0.0 111.248 -174.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.574 ' HD3' ' HB3' ' A' ' 108' ' ' CYS . 57.7 tttm -73.94 -14.64 61.08 Favored 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 124.723 1.209 . . . . 0.0 112.159 -177.342 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.529 ' HB2' ' HG2' ' A' ' 89' ' ' LYS . 4.3 m -132.31 -21.0 2.35 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -175.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 69.95 52.62 18.3 Favored Glycine 0 C--N 1.347 1.173 0 O-C-N 123.228 0.33 . . . . 0.0 112.623 -169.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.529 ' HG2' ' HB2' ' A' ' 87' ' ' CYS . 19.5 ptpt -143.88 -167.97 2.73 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.547 0.739 . . . . 0.0 109.558 176.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.3 mmm180 -76.65 160.85 29.03 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.962 0.905 . . . . 0.0 113.411 -178.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 19.1 mm -104.57 144.18 14.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 114.342 -1.299 . . . . 0.0 107.542 159.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.8 p -73.93 152.97 40.0 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.589 0.756 . . . . 0.0 110.767 176.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -68.45 -36.95 79.75 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.064 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -59.35 -40.4 86.26 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.031 0.933 . . . . 0.0 111.159 175.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 29.4 tpt180 -64.06 -45.32 89.31 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.143 175.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 95.7 mt -71.02 -32.92 69.83 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.407 0.683 . . . . 0.0 112.763 -175.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.3 ptpt -81.75 -27.43 33.82 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.489 0.315 . . . . 0.0 110.433 -177.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -78.43 -43.82 26.3 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.588 0.755 . . . . 0.0 110.493 174.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.7 p -152.86 95.38 3.03 Favored Pre-proline 0 CA--C 1.557 1.23 0 C-N-CA 124.478 1.111 . . . . 0.0 109.2 -176.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -74.44 -9.82 21.8 Favored 'Trans proline' 0 C--N 1.376 2.014 0 C-N-CA 122.615 2.21 . . . . 0.0 112.487 175.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 11.1 p90 -102.92 67.01 0.94 Allowed 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.206 1.002 . . . . 0.0 108.965 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 10.4 t -140.92 117.91 7.74 Favored Pre-proline 0 CA--C 1.551 0.983 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.575 177.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.23 -24.34 23.33 Favored 'Trans proline' 0 C--N 1.373 1.838 0 C-N-CA 122.262 1.975 . . . . 0.0 111.8 173.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -105.54 144.82 31.77 Favored 'General case' 0 C--N 1.352 0.713 0 CA-C-O 122.305 1.05 . . . . 0.0 111.133 -176.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.829 ' SG ' ' HB2' ' A' ' 108' ' ' CYS . 3.5 p -64.3 164.97 10.25 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 113.628 -1.624 . . . . 0.0 110.556 167.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.2 tt0 -55.34 -51.82 65.5 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 123.895 0.878 . . . . 0.0 112.367 -174.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.56 -29.82 52.34 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -174.569 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.829 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 75.7 m -78.34 -25.61 46.48 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.358 0.263 . . . . 0.0 111.366 177.072 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.05 -35.45 69.33 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 123.705 0.628 . . . . 0.0 109.878 169.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.38 -29.09 63.44 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.82 0.848 . . . . 0.0 112.054 178.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -117.32 33.13 5.78 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.689 0.796 . . . . 0.0 111.462 -174.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.502 HD23 ' HE3' ' A' ' 86' ' ' LYS . 54.6 mt . . . . . 0 N--CA 1.492 1.628 0 C-N-CA 123.678 0.791 . . . . 0.0 111.25 175.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 4.7 tt . . . . . 0 N--CA 1.482 1.171 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 64.04 -77.33 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 125.086 1.354 . . . . 0.0 111.123 -178.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -80.65 -64.47 1.81 Allowed Glycine 0 C--N 1.347 1.152 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 172.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 85.06 21.97 53.76 Favored Glycine 0 C--N 1.354 1.57 0 N-CA-C 114.148 0.419 . . . . 0.0 114.148 177.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? -83.82 -7.05 59.54 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.635 0.774 . . . . 0.0 112.019 -178.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 32.7 t -113.65 150.07 33.72 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 171.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 54.9 ttm -65.6 -35.61 81.32 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 122.651 0.381 . . . . 0.0 110.072 177.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 55.4 t30 58.97 68.81 0.78 Allowed 'General case' 0 C--O 1.246 0.906 0 C-N-CA 124.935 1.294 . . . . 0.0 110.121 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 81.7 t -65.5 -32.44 58.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 CA-C-N 114.238 -1.346 . . . . 0.0 111.135 -177.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -59.58 -36.34 76.05 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.191 0.996 . . . . 0.0 112.599 -176.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 71.9 m -69.88 -39.21 76.43 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 122.715 0.406 . . . . 0.0 111.064 176.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -68.99 -34.27 75.03 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.098 0.559 . . . . 0.0 110.043 175.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -63.22 -56.23 18.38 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.749 1.22 . . . . 0.0 109.259 -177.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.445 ' NZ ' ' HB2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -67.61 -39.84 84.71 Favored 'General case' 0 C--O 1.219 -0.545 0 CA-C-N 115.696 -0.683 . . . . 0.0 112.164 -175.057 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 13.5 tt -64.98 -31.77 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 CA-C-O 120.965 0.412 . . . . 0.0 110.242 -177.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.58 ' HB3' HG23 ' A' ' 69' ' ' ILE . 64.4 mt -69.63 -42.0 74.89 Favored 'General case' 0 C--N 1.349 0.556 0 C-N-CA 123.368 0.667 . . . . 0.0 110.847 174.084 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.5 ' O ' ' HG2' ' A' ' 21' ' ' ARG . 1.8 mmp_? -61.67 -46.35 90.1 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 123.388 0.675 . . . . 0.0 110.361 177.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -59.11 -47.34 85.61 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.583 0.753 . . . . 0.0 110.551 178.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -66.43 -41.27 89.44 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 114.806 -1.088 . . . . 0.0 111.544 -176.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.678 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.8 pt20 -71.68 -32.99 68.44 Favored 'General case' 0 C--O 1.212 -0.918 0 CA-C-O 118.525 -0.75 . . . . 0.0 110.673 -177.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.5 ' HG2' ' O ' ' A' ' 17' ' ' ARG . 22.9 mmt180 -67.6 -46.81 71.5 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.192 0.597 . . . . 0.0 110.826 -177.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -66.54 -32.88 74.5 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.871 178.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.532 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 89.4 mt -77.58 -32.24 53.57 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-O 118.631 -0.7 . . . . 0.0 111.842 176.364 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -58.54 -54.46 46.75 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 123.239 0.616 . . . . 0.0 109.507 178.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.5 ptt180 -72.83 -25.84 61.27 Favored 'General case' 0 CA--C 1.549 0.913 0 CA-C-N 114.832 -1.076 . . . . 0.0 111.522 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 52.3 ttm-85 -63.15 -52.08 63.89 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.022 0.529 . . . . 0.0 112.102 175.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.63 HD21 HD22 ' A' ' 66' ' ' LEU . 2.9 pp -81.44 -25.67 35.94 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 122.334 -0.229 . . . . 0.0 111.02 -178.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 6.1 m170 -86.87 32.26 0.68 Allowed 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 122.952 0.501 . . . . 0.0 110.594 169.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 20.2 pttp -61.63 -29.42 70.04 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 124.511 1.124 . . . . 0.0 112.069 176.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.512 ' H ' HD13 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -63.9 -26.11 39.78 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 123.521 0.728 . . . . 0.0 111.618 174.96 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -97.45 -34.21 11.1 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.459 1.104 . . . . 0.0 110.551 177.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -89.75 118.93 29.72 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.133 -0.939 . . . . 0.0 110.72 -171.228 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -73.79 -7.85 53.74 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.781 0.832 . . . . 0.0 111.309 173.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 63.8 t80 67.16 75.47 0.31 Allowed 'General case' 0 C--N 1.356 0.88 0 C-N-CA 125.754 1.621 . . . . 0.0 109.668 179.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -71.03 -39.28 72.43 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 114.869 -1.059 . . . . 0.0 109.247 170.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 69.06 110.56 0.03 OUTLIER Pre-proline 0 C--N 1.36 1.048 0 O-C-N 124.977 1.423 . . . . 0.0 110.623 -178.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -69.09 109.85 2.28 Favored 'Trans proline' 0 C--N 1.369 1.613 0 C-N-CA 121.714 1.609 . . . . 0.0 110.047 168.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -61.68 -19.5 62.42 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.06 0.944 . . . . 0.0 111.517 -179.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -136.67 150.49 70.29 Favored Pre-proline 0 CA--C 1.542 0.665 0 C-N-CA 124.579 1.152 . . . . 0.0 108.312 169.401 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -74.35 75.93 3.26 Favored 'Trans proline' 0 C--N 1.374 1.92 0 C-N-CA 122.439 2.093 . . . . 0.0 110.418 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -72.46 -37.87 68.4 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 114.629 -1.169 . . . . 0.0 108.908 -179.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -83.83 73.43 10.31 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 114.31 -1.314 . . . . 0.0 109.869 176.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -59.39 -48.02 83.21 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 114.654 -1.157 . . . . 0.0 108.97 172.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.474 ' HB2' ' HD3' ' A' ' 17' ' ' ARG . 24.4 t70 -159.9 90.44 0.92 Allowed 'General case' 0 C--O 1.239 0.533 0 CA-C-N 114.339 -1.301 . . . . 0.0 108.012 168.1 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -97.62 52.82 1.11 Allowed 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 -178.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 64.96 153.1 0.06 Allowed 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 125.135 1.374 . . . . 0.0 112.467 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.9 p -118.82 -83.09 0.65 Allowed 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 175.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 61.78 168.56 0.11 Allowed 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.689 1.196 . . . . 0.0 112.926 174.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 52.78 -96.22 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.709 1.204 . . . . 0.0 110.13 -173.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.8 m 57.19 170.03 0.04 OUTLIER 'General case' 0 C--N 1.363 1.181 0 C-N-CA 125.416 1.486 . . . . 0.0 112.407 -177.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.0 t-20 66.03 177.91 0.21 Allowed 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.607 0.763 . . . . 0.0 109.97 177.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.4 t70 64.49 17.25 10.73 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 122.188 0.994 . . . . 0.0 110.21 -176.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -88.18 70.89 9.26 Favored 'General case' 0 C--O 1.246 0.884 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 -179.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 41.7 t -66.98 -25.31 34.02 Favored 'Isoleucine or valine' 0 C--O 1.241 0.613 0 CA-C-N 113.714 -1.585 . . . . 0.0 110.666 -173.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.8 tp -56.15 110.84 0.82 Allowed 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.94 0.896 . . . . 0.0 110.547 178.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -79.25 -3.15 44.54 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 123.69 0.796 . . . . 0.0 111.264 -174.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -66.78 -12.36 58.53 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.569 0.748 . . . . 0.0 111.861 174.113 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 12.5 mt -73.79 131.74 41.87 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 171.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -60.79 130.74 48.38 Favored Glycine 0 C--N 1.346 1.085 0 CA-C-O 119.074 -0.848 . . . . 0.0 111.906 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -64.29 -43.2 95.48 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.244 0.617 . . . . 0.0 111.104 -174.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 7.8 p -58.9 -35.04 54.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 123.199 0.6 . . . . 0.0 110.958 173.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.43 -43.71 76.82 Favored Glycine 0 C--N 1.345 1.082 0 O-C-N 123.647 0.592 . . . . 0.0 112.205 175.135 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -67.5 -47.87 68.75 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 124.024 0.93 . . . . 0.0 111.554 -176.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -67.66 -39.3 84.55 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.445 0.698 . . . . 0.0 110.806 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -70.75 -33.17 70.53 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 123.44 0.463 . . . . 0.0 110.129 179.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.63 HD22 HD21 ' A' ' 27' ' ' LEU . 2.5 mp -66.18 -41.33 90.43 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.344 0.658 . . . . 0.0 110.791 173.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 56.4 ttt180 -58.05 -42.96 86.55 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 123.656 0.597 . . . . 0.0 109.62 175.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.02 -39.71 75.65 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.42 1.088 . . . . 0.0 111.919 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.678 HG21 ' HB3' ' A' ' 20' ' ' GLN . 72.9 mt -68.69 -54.08 23.15 Favored 'Isoleucine or valine' 0 C--N 1.359 1.012 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -178.488 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -67.09 -23.27 65.83 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.331 1.052 . . . . 0.0 112.605 179.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.467 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -65.85 -54.56 25.1 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 170.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.486 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -58.81 -42.38 89.03 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 124.448 1.092 . . . . 0.0 111.339 -178.361 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.508 HD23 HD12 ' A' ' 76' ' ' ILE . 95.5 mt -68.04 -38.42 82.49 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.319 1.047 . . . . 0.0 111.721 179.469 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.34 -33.0 74.93 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.173 0.589 . . . . 0.0 110.394 174.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.467 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 80.5 mtt-85 -74.91 -27.4 60.2 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.588 0.755 . . . . 0.0 111.36 177.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.508 HD12 HD23 ' A' ' 73' ' ' LEU . 76.2 mt -69.89 -44.6 78.63 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 174.129 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.37 -32.97 74.88 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 114.825 -1.08 . . . . 0.0 111.324 176.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 26.6 t -84.08 -23.2 30.91 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.439 0.696 . . . . 0.0 111.627 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 86.95 16.63 60.86 Favored Glycine 0 C--N 1.35 1.31 0 O-C-N 123.298 0.374 . . . . 0.0 113.785 -178.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.4 t -114.36 18.83 16.68 Favored 'General case' 0 CA--C 1.559 1.291 0 C-N-CA 124.111 0.964 . . . . 0.0 111.372 178.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -72.66 137.61 46.15 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 170.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.453 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 88.5 11.42 66.37 Favored Glycine 0 CA--C 1.528 0.857 0 O-C-N 123.987 0.804 . . . . 0.0 111.918 -171.444 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 22.7 m -118.79 118.2 30.95 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.511 0.724 . . . . 0.0 109.656 175.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 46.5 t -74.2 92.84 2.26 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.898 171.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 27.0 m -66.84 -14.45 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 124.041 0.936 . . . . 0.0 112.755 -177.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 47.7 tttm -76.49 -17.41 59.3 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.152 0.581 . . . . 0.0 111.844 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 31.0 p -144.26 8.6 1.4 Allowed 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 176.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 62.43 32.38 82.82 Favored Glycine 0 C--N 1.358 1.759 0 C-N-CA 123.247 0.451 . . . . 0.0 114.196 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 32.3 mmmt -116.05 -171.39 1.98 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.499 0.72 . . . . 0.0 110.067 -176.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.453 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 24.2 tpp180 -89.12 151.42 22.22 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.176 0.991 . . . . 0.0 110.364 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 9.8 mm -92.5 138.74 19.32 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 165.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 39.0 m -73.92 151.38 40.41 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 122.619 0.368 . . . . 0.0 110.54 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -61.36 -41.43 97.06 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.405 0.682 . . . . 0.0 109.896 174.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.421 ' HA ' ' HG2' ' A' ' 97' ' ' LYS . 64.0 m-20 -67.13 -33.58 75.75 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.286 178.369 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.455 ' HG3' HG21 ' A' ' 102' ' ' THR . 1.0 OUTLIER -66.43 -44.1 83.81 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.42 0.688 . . . . 0.0 109.583 174.918 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 79.4 mt -71.19 -36.01 71.78 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.764 0.826 . . . . 0.0 112.037 -177.161 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.421 ' HG2' ' HA ' ' A' ' 94' ' ' ASP . 16.0 ptpt -77.08 -28.18 54.52 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 110.256 -0.275 . . . . 0.0 110.256 -177.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -79.12 -40.48 30.95 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.493 0.717 . . . . 0.0 110.732 175.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.2 p -152.61 94.3 3.19 Favored Pre-proline 0 CA--C 1.556 1.183 0 C-N-CA 124.625 1.17 . . . . 0.0 108.79 -176.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.98 -13.1 19.54 Favored 'Trans proline' 0 C--N 1.375 1.935 0 C-N-CA 122.61 2.207 . . . . 0.0 113.816 -179.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 36.2 p90 -90.69 7.71 38.12 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -179.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.455 HG21 ' HG3' ' A' ' 95' ' ' ARG . 15.0 t -82.74 123.77 77.9 Favored Pre-proline 0 CA--C 1.562 1.418 0 CA-C-N 118.112 0.415 . . . . 0.0 110.735 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -84.29 0.63 9.09 Favored 'Trans proline' 0 C--N 1.368 1.605 0 C-N-CA 122.61 2.207 . . . . 0.0 111.645 167.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -117.39 141.63 48.09 Favored 'General case' 0 C--N 1.353 0.744 0 C-N-CA 123.929 0.892 . . . . 0.0 110.577 -173.055 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.64 ' SG ' ' HG3' ' A' ' 107' ' ' GLU . 19.8 p -80.18 173.48 12.56 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 174.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -60.96 -35.08 75.84 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -172.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.64 ' HG3' ' SG ' ' A' ' 105' ' ' CYS . 0.0 OUTLIER -72.24 -32.64 66.88 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 178.48 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 91.8 m -73.87 -38.8 64.31 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 122.452 0.301 . . . . 0.0 110.784 173.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.91 -32.54 74.3 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.129 0.972 . . . . 0.0 111.187 175.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.25 -33.45 69.83 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.74 0.816 . . . . 0.0 110.708 174.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -79.4 -10.73 59.87 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.852 177.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 90.3 mt . . . . . 0 C--O 1.25 1.119 0 CA-C-O 118.452 -0.785 . . . . 0.0 109.105 173.013 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.3 pp . . . . . 0 N--CA 1.488 1.426 0 CA-C-O 119.622 -0.228 . . . . 0.0 110.65 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 69.12 169.78 0.29 Allowed 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 124.795 1.238 . . . . 0.0 113.006 177.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 90.44 178.43 44.1 Favored Glycine 0 C--N 1.347 1.181 0 CA-C-N 116.065 -0.516 . . . . 0.0 113.294 177.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -165.62 116.72 0.71 Allowed Glycine 0 C--N 1.347 1.145 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -96.26 56.36 1.6 Allowed 'General case' 0 N--CA 1.48 1.075 0 CA-C-O 121.696 0.76 . . . . 0.0 109.847 -175.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.2 t -174.73 168.99 3.62 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.575 1.15 . . . . 0.0 109.669 178.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 48.4 ttp 63.05 12.9 6.3 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 124.917 1.287 . . . . 0.0 112.271 172.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 16.7 m120 63.82 25.47 14.08 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 124.839 1.256 . . . . 0.0 112.061 -175.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.401 HG22 ' HD2' ' A' ' 81' ' ' PHE . 37.7 t -50.04 -42.38 19.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 C-N-CA 124.535 1.134 . . . . 0.0 111.817 178.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -70.62 -36.17 73.33 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 123.855 0.722 . . . . 0.0 111.925 -175.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 57.5 m -68.3 -35.77 78.33 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 173.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.419 ' HA ' HG22 ' A' ' 15' ' ' ILE . 23.1 m-85 -70.3 -36.47 74.35 Favored 'General case' 0 C--O 1.215 -0.758 0 C-N-CA 123.252 0.621 . . . . 0.0 110.403 176.404 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -63.31 -52.19 62.92 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.207 1.003 . . . . 0.0 110.303 -175.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.82 -42.3 95.09 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.471 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.527 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 10.6 tt -69.2 -32.76 55.1 Favored 'Isoleucine or valine' 0 C--N 1.365 1.261 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 -177.039 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.45 ' HB3' HG23 ' A' ' 69' ' ' ILE . 52.8 mt -62.78 -41.87 99.44 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 122.793 0.437 . . . . 0.0 110.451 175.438 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.523 ' O ' ' HG2' ' A' ' 21' ' ' ARG . 17.4 mtm180 -60.83 -52.62 64.28 Favored 'General case' 0 C--O 1.215 -0.737 0 O-C-N 123.626 0.579 . . . . 0.0 109.448 175.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -53.95 -44.86 71.06 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.43 0.692 . . . . 0.0 111.422 -176.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.527 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -61.44 -51.21 69.67 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 124.306 1.004 . . . . 0.0 110.867 178.956 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.666 ' HB3' HG21 ' A' ' 69' ' ' ILE . 1.8 pt20 -67.83 -29.84 69.09 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 122.983 0.177 . . . . 0.0 110.941 -176.071 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.597 ' HB3' ' HB2' ' A' ' 47' ' ' SER . 29.2 mmt180 -71.41 -54.39 10.84 Favored 'General case' 0 C--N 1.354 0.781 0 C-N-CA 123.623 0.769 . . . . 0.0 110.131 -177.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -61.63 -29.93 70.37 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.109 0.564 . . . . 0.0 110.584 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.617 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 82.5 mt -69.83 -43.32 72.22 Favored 'General case' 0 C--O 1.212 -0.869 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.94 170.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.43 ' O ' ' HB2' ' A' ' 28' ' ' HIS . 2.0 m-85 -56.83 -37.15 70.84 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.099 0.56 . . . . 0.0 112.062 -177.612 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.498 HH22 ' ND2' ' A' ' 39' ' ' ASN . 35.7 ptt180 -80.46 -29.7 37.47 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 122.169 0.187 . . . . 0.0 111.172 174.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 47.7 ttt85 -66.83 -37.77 85.13 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.95 0.9 . . . . 0.0 112.23 177.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.617 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 1.7 pp -97.22 -35.48 10.74 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 122.473 0.309 . . . . 0.0 111.288 -177.203 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.43 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 52.1 m-70 -92.2 45.57 1.21 Allowed 'General case' 0 N--CA 1.486 1.335 0 CA-C-O 122.242 1.02 . . . . 0.0 109.341 168.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 18.7 pttp -65.12 -21.33 66.78 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 125.502 1.521 . . . . 0.0 112.017 174.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.421 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -64.28 -25.82 38.92 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 123.187 0.595 . . . . 0.0 112.226 178.58 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -113.92 -20.0 11.23 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.763 0.825 . . . . 0.0 110.9 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -92.98 85.3 5.08 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 175.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -105.91 84.3 2.04 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.848 0.859 . . . . 0.0 110.547 -177.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 21.5 t80 62.75 18.71 10.88 Favored 'General case' 0 CA--C 1.562 1.412 0 C-N-CA 124.846 1.258 . . . . 0.0 112.374 170.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -61.63 -43.31 99.1 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-O 121.979 0.895 . . . . 0.0 109.383 175.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.442 ' HG3' HH11 ' A' ' 25' ' ' ARG . 10.2 pt-20 -145.14 112.92 4.81 Favored Pre-proline 0 CA--C 1.549 0.911 0 CA-C-N 113.891 -1.504 . . . . 0.0 107.74 167.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.48 178.74 6.96 Favored 'Trans proline' 0 C--N 1.37 1.662 0 C-N-CA 122.662 2.241 . . . . 0.0 112.76 177.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 37.5 ptt180 -52.7 125.57 17.12 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 125.542 1.537 . . . . 0.0 112.16 -177.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.498 ' ND2' HH22 ' A' ' 25' ' ' ARG . 3.9 p30 -135.83 84.21 32.88 Favored Pre-proline 0 CA--C 1.551 1.009 0 C-N-CA 123.387 0.675 . . . . 0.0 109.298 176.174 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -75.49 -23.33 13.12 Favored 'Trans proline' 0 C--N 1.384 2.399 0 C-N-CA 123.059 2.506 . . . . 0.0 112.398 -179.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -91.08 171.01 9.55 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 124.296 1.038 . . . . 0.0 109.946 174.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -72.78 86.82 1.26 Allowed 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 123.512 0.725 . . . . 0.0 111.445 -171.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -114.01 -54.99 2.55 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.122 0.969 . . . . 0.0 108.637 172.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.7 t70 61.25 100.03 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.959 1.304 . . . . 0.0 111.756 175.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 22.5 mmt180 -102.08 -77.72 0.55 Allowed 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 122.749 0.42 . . . . 0.0 110.363 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -161.51 -80.7 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 117.847 0.294 . . . . 0.0 111.062 176.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.597 ' HB2' ' HB3' ' A' ' 21' ' ' ARG . 19.3 m 57.58 27.1 13.65 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 125.066 1.346 . . . . 0.0 110.815 -170.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.577 ' HG3' ' HG3' ' A' ' 49' ' ' ARG . 10.3 tp10 -57.94 -59.13 5.72 Favored 'General case' 0 C--N 1.353 0.719 0 C-N-CA 125.002 1.321 . . . . 0.0 112.603 -165.198 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.577 ' HG3' ' HG3' ' A' ' 48' ' ' GLU . 99.7 mtt180 -136.21 169.06 18.24 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.643 0.735 . . . . 0.0 111.258 -174.701 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.8 t -162.91 -171.57 2.73 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 113.946 -1.479 . . . . 0.0 107.995 -173.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -68.77 112.94 5.8 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 165.066 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -69.71 -18.26 63.52 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.497 0.719 . . . . 0.0 111.831 -171.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -67.79 158.98 31.2 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 122.907 0.483 . . . . 0.0 110.822 175.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 90.1 t -69.4 -79.26 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.578 -173.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.489 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 65.5 tp 70.77 137.42 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.851 0 C-N-CA 124.569 1.147 . . . . 0.0 110.655 -172.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -81.06 15.74 1.76 Allowed 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -175.234 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -91.94 2.29 56.64 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.439 0.695 . . . . 0.0 111.023 173.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 12.4 mt -81.52 167.21 19.56 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.747 0.419 . . . . 0.0 111.046 178.688 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -95.57 132.04 10.92 Favored Glycine 0 C--N 1.346 1.102 0 N-CA-C 110.85 -0.9 . . . . 0.0 110.85 172.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -51.62 -51.99 51.25 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 124.49 1.116 . . . . 0.0 112.906 -175.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 7.4 p -66.49 -32.15 56.75 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 C-N-CA 123.851 0.86 . . . . 0.0 111.003 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -63.46 -36.93 94.03 Favored Glycine 0 C--N 1.347 1.174 0 N-CA-C 111.903 -0.479 . . . . 0.0 111.903 175.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -76.99 -41.12 44.15 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.312 1.045 . . . . 0.0 111.552 -178.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -67.74 -39.06 84.25 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.533 0.733 . . . . 0.0 110.197 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -70.64 -39.7 73.52 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.545 178.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.1 mp -56.2 -47.2 78.84 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.024 0.929 . . . . 0.0 110.313 172.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -63.37 -37.32 86.8 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.704 0.802 . . . . 0.0 110.693 -176.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.75 -37.8 70.49 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.664 0.786 . . . . 0.0 111.182 178.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.666 HG21 ' HB3' ' A' ' 20' ' ' GLN . 85.4 mt -67.32 -52.24 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 123.973 0.909 . . . . 0.0 110.51 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.8 -29.74 70.72 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.24 1.016 . . . . 0.0 111.213 -179.17 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.405 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -65.4 -46.14 81.19 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 122.973 0.509 . . . . 0.0 110.043 173.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.51 ' HB1' ' HE1' ' A' ' 81' ' ' PHE . . . -66.42 -39.98 89.28 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.391 179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.512 HD23 HD12 ' A' ' 76' ' ' ILE . 68.3 mt -69.83 -32.17 70.45 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.06 0.944 . . . . 0.0 111.188 178.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.54 -34.82 79.14 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.348 0.659 . . . . 0.0 110.544 174.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.405 ' HG2' ' O ' ' A' ' 71' ' ' ALA . 17.8 mmt180 -72.04 -37.95 69.63 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.501 176.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.512 HD12 HD23 ' A' ' 73' ' ' LEU . 59.6 mt -65.69 -41.62 90.88 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 CA-C-O 121.224 0.535 . . . . 0.0 109.629 175.636 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -67.66 -25.06 65.52 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.438 1.095 . . . . 0.0 111.933 178.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 27.5 t -100.37 2.58 42.54 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 123.739 0.816 . . . . 0.0 111.084 177.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 66.51 19.64 69.06 Favored Glycine 0 C--N 1.358 1.771 0 N-CA-C 114.452 0.541 . . . . 0.0 114.452 176.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 9.0 t -127.4 29.2 5.57 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 124.519 1.127 . . . . 0.0 110.873 -177.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.51 ' HE1' ' HB1' ' A' ' 72' ' ' ALA . 68.5 t80 -59.35 143.67 48.84 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 122.821 0.449 . . . . 0.0 110.317 167.377 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 83.48 33.63 21.93 Favored Glycine 0 C--N 1.34 0.757 0 O-C-N 123.779 0.674 . . . . 0.0 111.623 -173.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 59.1 m -125.66 120.36 30.51 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.385 0.674 . . . . 0.0 110.074 175.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.423 ' HB2' ' HB3' ' A' ' 105' ' ' CYS . 48.7 t -76.66 102.18 6.06 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 123.807 0.843 . . . . 0.0 110.613 175.131 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 16.4 m -74.2 -11.45 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 124.157 0.983 . . . . 0.0 112.408 -175.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 52.4 tttm -81.03 -24.83 37.61 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.073 0.549 . . . . 0.0 111.381 -178.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.439 ' SG ' ' HB2' ' A' ' 89' ' ' LYS . 23.3 p -139.01 11.3 2.62 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 -178.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 62.21 26.66 67.98 Favored Glycine 0 C--N 1.353 1.512 0 N-CA-C 114.0 0.36 . . . . 0.0 114.0 -179.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.439 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 85.5 mttt -103.66 -168.89 1.56 Allowed 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.373 0.669 . . . . 0.0 110.853 -179.251 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 1.8 tmt_? -96.98 159.56 14.84 Favored 'General case' 0 CA--C 1.559 1.322 0 C-N-CA 124.796 1.239 . . . . 0.0 107.718 176.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 9.1 mm -96.25 134.21 34.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 171.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.1 m -61.73 143.64 55.89 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.476 0.711 . . . . 0.0 110.314 177.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -66.25 -38.08 87.0 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 118.104 0.411 . . . . 0.0 110.724 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -57.76 -40.1 78.95 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.489 0.715 . . . . 0.0 110.786 173.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.581 ' HG3' HG21 ' A' ' 102' ' ' THR . 25.2 tpt180 -66.32 -42.28 88.43 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.427 176.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 83.9 mt -68.93 -38.15 79.34 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.784 0.834 . . . . 0.0 112.628 -176.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -78.67 -32.16 47.04 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 122.399 0.28 . . . . 0.0 110.339 -176.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.65 -38.14 65.07 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.469 0.708 . . . . 0.0 110.749 176.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 1.7 p -155.61 99.52 2.25 Favored Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 124.773 1.229 . . . . 0.0 108.911 -178.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -73.02 -15.88 25.83 Favored 'Trans proline' 0 C--N 1.371 1.73 0 C-N-CA 122.445 2.096 . . . . 0.0 113.173 176.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 19.5 p90 -95.0 64.68 2.83 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 122.251 1.025 . . . . 0.0 109.333 179.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.581 HG21 ' HG3' ' A' ' 95' ' ' ARG . 13.5 t -137.94 108.53 8.32 Favored Pre-proline 0 CA--C 1.559 1.315 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.061 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.28 -8.03 18.34 Favored 'Trans proline' 0 C--N 1.371 1.757 0 C-N-CA 122.668 2.245 . . . . 0.0 112.056 169.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -104.68 140.22 38.37 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.06 0.944 . . . . 0.0 109.558 -178.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.423 ' HB3' ' HB2' ' A' ' 84' ' ' CYS . 30.3 p -78.06 169.89 17.51 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 174.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -52.67 -37.72 59.22 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 123.518 0.727 . . . . 0.0 111.067 -178.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -57.85 -54.56 45.58 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.316 174.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 93.2 m -70.25 -26.82 64.01 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.387 -174.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.61 -44.05 87.76 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.78 0.832 . . . . 0.0 110.151 174.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -74.48 -20.1 60.13 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.439 177.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -95.32 3.88 54.0 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.107 0.963 . . . . 0.0 112.578 -177.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 92.4 mt . . . . . 0 N--CA 1.484 1.235 0 CA-C-O 119.228 -0.415 . . . . 0.0 110.664 178.279 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.488 HD11 HG22 ' A' ' 76' ' ' ILE . 2.5 tm? . . . . . 0 N--CA 1.484 1.242 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 64.94 176.81 0.2 Allowed 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 125.097 1.359 . . . . 0.0 112.613 -178.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 73.49 -81.55 0.72 Allowed Glycine 0 C--N 1.341 0.857 0 N-CA-C 110.562 -1.015 . . . . 0.0 110.562 -171.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 70.53 -80.58 0.41 Allowed Glycine 0 C--N 1.351 1.392 0 CA-C-O 119.743 -0.476 . . . . 0.0 113.375 174.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 68.52 135.26 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 126.161 1.784 . . . . 0.0 111.268 -171.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 30.7 p -73.58 92.39 1.92 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 123.369 0.667 . . . . 0.0 109.819 176.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . 0.514 ' HB3' HG23 ' A' ' 9' ' ' VAL . 34.7 ttm -152.26 11.84 0.55 Allowed 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.341 1.056 . . . . 0.0 109.306 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.8 m120 63.79 33.21 12.98 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 124.101 0.961 . . . . 0.0 110.166 -170.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.514 HG23 ' HB3' ' A' ' 7' ' ' MET . 72.7 t -60.55 -37.58 75.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 123.95 0.9 . . . . 0.0 111.435 -178.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -69.27 -31.84 70.63 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.142 0.577 . . . . 0.0 111.008 -179.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.3 m -66.71 -39.67 88.12 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.224 0.609 . . . . 0.0 109.974 174.203 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -70.23 -37.57 75.01 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.257 176.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -60.4 -53.57 56.01 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.533 1.133 . . . . 0.0 110.25 -175.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -64.75 -45.04 88.14 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.758 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.451 ' O ' ' HB2' ' A' ' 19' ' ' ARG . 10.9 tt -66.11 -32.37 57.84 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.263 0 N-CA-C 110.28 -0.267 . . . . 0.0 110.28 -174.401 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.615 ' HB3' HG23 ' A' ' 69' ' ' ILE . 69.7 mt -73.27 -38.05 66.07 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.019 0.928 . . . . 0.0 111.136 177.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.619 ' HE ' HD13 ' A' ' 73' ' ' LEU . 15.2 mmt85 -64.49 -41.96 96.15 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.52 0.728 . . . . 0.0 111.109 175.267 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -69.13 -35.92 76.92 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.451 ' HB2' ' O ' ' A' ' 15' ' ' ILE . 8.4 tpt180 -65.99 -48.96 69.47 Favored 'General case' 0 C--N 1.346 0.448 0 CA-C-N 114.341 -1.3 . . . . 0.0 110.799 -177.294 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.669 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.8 pt20 -70.76 -33.83 71.2 Favored 'General case' 0 C--O 1.216 -0.696 0 CA-C-O 118.947 -0.549 . . . . 0.0 110.96 -174.194 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 17' ' ' ARG . 32.5 mmt180 -76.4 -38.39 55.72 Favored 'General case' 0 C--N 1.362 1.144 0 O-C-N 123.456 0.473 . . . . 0.0 111.951 -176.084 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -67.43 -40.72 85.48 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 177.14 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.557 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 97.1 mt -69.73 -36.25 75.69 Favored 'General case' 0 C--N 1.346 0.442 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.505 175.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.449 ' HB2' ' O ' ' A' ' 20' ' ' GLN . 0.2 OUTLIER -58.61 -54.74 43.63 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.84 0.856 . . . . 0.0 110.318 -178.02 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.478 HH22 ' H ' ' A' ' 44' ' ' ASP . 6.9 ptm180 -69.11 -28.03 66.11 Favored 'General case' 0 CA--C 1.551 1.005 0 O-C-N 124.071 0.857 . . . . 0.0 110.815 -177.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 50.5 ttt85 -61.96 -55.04 33.49 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.826 0.85 . . . . 0.0 111.257 174.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.703 ' HB2' ' HA ' ' A' ' 58' ' ' LEU . 3.2 pp -82.51 -9.0 59.6 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 122.791 0.436 . . . . 0.0 111.904 -178.092 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 11.6 m170 -102.71 35.85 2.36 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.987 0.915 . . . . 0.0 109.017 171.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -58.27 -27.42 64.01 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.804 1.242 . . . . 0.0 112.578 175.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.567 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -65.08 -34.27 69.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.444 0.698 . . . . 0.0 112.136 178.86 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -104.13 -12.51 16.69 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.591 0.756 . . . . 0.0 110.864 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -133.19 69.99 1.47 Allowed 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.965 0.906 . . . . 0.0 109.216 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -94.78 111.92 23.68 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 114.609 -1.178 . . . . 0.0 109.91 -178.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -103.43 102.51 12.43 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.412 0.685 . . . . 0.0 109.553 178.198 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -68.26 -45.95 71.76 Favored 'General case' 0 N--CA 1.481 1.122 0 CA-C-O 121.713 0.768 . . . . 0.0 109.459 173.117 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -72.27 171.82 8.81 Favored Pre-proline 0 CA--C 1.557 1.227 0 CA-C-N 113.603 -1.635 . . . . 0.0 110.45 177.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -53.86 145.65 49.91 Favored 'Trans proline' 0 C--N 1.387 2.582 0 C-N-CA 122.267 1.978 . . . . 0.0 112.13 172.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 49.9 mtp180 -62.46 -26.83 68.73 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.621 -178.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 71.64 140.71 0.08 OUTLIER Pre-proline 0 CA--C 1.552 1.032 0 C-N-CA 125.733 1.613 . . . . 0.0 111.133 -178.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_endo -77.75 9.86 2.8 Favored 'Trans proline' 0 C--N 1.377 2.057 0 C-N-CA 122.823 2.349 . . . . 0.0 112.894 -178.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -112.6 150.58 31.19 Favored 'General case' 0 C--O 1.242 0.709 0 C-N-CA 124.528 1.131 . . . . 0.0 109.303 177.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -74.18 123.26 24.15 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.516 178.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -70.28 -48.94 54.53 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.063 0.945 . . . . 0.0 110.218 176.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.478 ' H ' HH22 ' A' ' 25' ' ' ARG . 20.2 t70 -164.63 134.51 3.86 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 114.72 -1.127 . . . . 0.0 108.434 -177.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 78.2 ttt180 -59.08 -47.62 84.59 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.252 1.021 . . . . 0.0 112.106 -173.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -164.45 129.88 2.81 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.161 0.584 . . . . 0.0 110.018 -177.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.6 t -79.98 175.92 10.2 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.01 0.524 . . . . 0.0 109.733 172.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.473 ' HG2' ' HD2' ' A' ' 49' ' ' ARG . 20.1 tt0 -66.2 -89.54 0.01 OUTLIER 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 123.031 0.532 . . . . 0.0 110.068 -179.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.473 ' HD2' ' HG2' ' A' ' 48' ' ' GLU . 2.8 mpt_? -145.0 -64.79 0.34 Allowed 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 174.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.7 m 62.37 -69.95 0.06 Allowed 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.628 1.571 . . . . 0.0 112.338 -178.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -70.59 86.19 0.64 Allowed 'General case' 0 CA--C 1.55 0.956 0 CA-C-O 121.398 0.618 . . . . 0.0 109.412 172.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -79.23 -27.38 42.44 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.739 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -78.0 178.24 7.65 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.142 0.977 . . . . 0.0 111.612 179.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 85.0 t -73.97 -67.59 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 173.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.462 HD21 HG21 ' A' ' 30' ' ' ILE . 33.4 tp 65.48 135.68 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 125.502 1.521 . . . . 0.0 112.924 178.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -65.52 -24.13 67.05 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.863 0.865 . . . . 0.0 112.42 -176.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.401 ' H ' ' HG ' ' A' ' 55' ' ' LEU . 26.4 mm-40 -65.68 -21.7 66.57 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.245 0.618 . . . . 0.0 111.783 -179.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.703 ' HA ' ' HB2' ' A' ' 27' ' ' LEU . 6.8 mp -83.09 109.78 17.44 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.276 -0.875 . . . . 0.0 109.021 168.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -77.97 149.25 34.21 Favored Glycine 0 C--N 1.346 1.117 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.784 -175.256 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -57.18 -49.35 76.25 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.551 1.141 . . . . 0.0 112.521 -175.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 9.8 p -61.06 -38.0 78.6 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.772 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.51 -51.38 31.68 Favored Glycine 0 C--N 1.348 1.23 0 O-C-N 123.704 0.628 . . . . 0.0 112.497 -179.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -64.1 -47.39 80.21 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.564 0.746 . . . . 0.0 111.235 -175.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.25 -22.86 59.14 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.751 -177.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -74.51 -44.81 49.55 Favored 'General case' 0 C--O 1.209 -1.035 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 173.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.44 HD11 ' HB2' ' A' ' 23' ' ' LEU . 5.1 mp -55.74 -43.24 76.44 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 124.122 0.969 . . . . 0.0 110.72 173.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 55.7 ttt180 -57.77 -45.93 85.28 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.252 1.021 . . . . 0.0 110.898 176.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -73.74 -33.47 64.34 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.438 -179.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.669 HG21 ' HB3' ' A' ' 20' ' ' GLN . 66.7 mt -69.18 -51.22 45.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.127 0.971 . . . . 0.0 109.226 -178.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -65.88 -27.04 67.92 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.182 0.993 . . . . 0.0 111.736 177.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.73 -42.82 81.26 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 122.792 0.437 . . . . 0.0 109.969 172.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.445 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -69.39 -39.71 77.82 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.773 0.829 . . . . 0.0 111.374 179.033 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.619 HD13 ' HE ' ' A' ' 17' ' ' ARG . 89.7 mt -72.68 -29.01 63.05 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.153 0.981 . . . . 0.0 110.939 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.36 -35.38 75.8 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.488 0.715 . . . . 0.0 110.164 173.211 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 67.2 mtm180 -64.32 -44.73 90.65 Favored 'General case' 0 C--N 1.355 0.846 0 O-C-N 123.6 0.563 . . . . 0.0 110.483 173.055 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.564 HD12 HD23 ' A' ' 73' ' ' LEU . 63.5 mt -63.35 -45.71 97.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 -179.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.78 -29.33 70.55 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.289 1.036 . . . . 0.0 111.717 179.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.517 ' HB3' HG22 ' A' ' 80' ' ' THR . 33.5 t -88.57 -12.3 43.1 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 123.964 0.906 . . . . 0.0 111.222 177.609 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 73.58 25.67 71.76 Favored Glycine 0 C--N 1.352 1.464 0 CA-C-N 116.768 -0.197 . . . . 0.0 112.868 -177.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.517 HG22 ' HB3' ' A' ' 78' ' ' SER . 14.7 t -123.62 25.82 8.01 Favored 'General case' 0 CA--C 1.556 1.209 0 C-N-CA 124.668 1.187 . . . . 0.0 110.375 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -66.18 140.87 58.22 Favored 'General case' 0 N--CA 1.477 0.913 0 O-C-N 121.538 -0.726 . . . . 0.0 110.232 171.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.406 ' HA2' HD11 ' A' ' 96' ' ' LEU . . . 83.63 27.6 38.28 Favored Glycine 0 C--N 1.342 0.906 0 O-C-N 123.732 0.645 . . . . 0.0 111.52 -171.005 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 94.3 m -116.09 122.05 44.0 Favored 'General case' 0 C--O 1.242 0.708 0 C-N-CA 123.656 0.783 . . . . 0.0 110.182 175.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 13.1 t -66.51 95.96 0.35 Allowed 'General case' 0 C--N 1.348 0.528 0 C-N-CA 124.31 1.044 . . . . 0.0 108.623 173.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 11.8 m -63.29 -29.84 48.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 C-N-CA 123.991 0.916 . . . . 0.0 112.075 -170.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -72.09 -21.01 61.56 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.357 1.063 . . . . 0.0 111.081 -179.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 6.5 m -119.63 -16.74 8.79 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.752 0.821 . . . . 0.0 112.276 -169.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 56.95 47.68 85.06 Favored Glycine 0 C--N 1.355 1.591 0 N-CA-C 111.316 -0.714 . . . . 0.0 111.316 -166.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -138.84 -157.58 0.78 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.572 1.149 . . . . 0.0 110.116 -171.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 11.4 tpt180 -97.64 145.78 25.96 Favored 'General case' 0 CA--C 1.564 1.485 0 C-N-CA 124.083 0.953 . . . . 0.0 112.47 -176.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 5.4 mm -95.01 148.77 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 164.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.8 m -75.44 144.54 42.1 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 174.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -61.67 -37.64 84.83 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.082 0.553 . . . . 0.0 110.326 175.154 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -62.15 -38.43 88.98 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.942 0.897 . . . . 0.0 111.378 177.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.451 ' HG3' HG21 ' A' ' 102' ' ' THR . 30.3 tpt180 -64.28 -40.51 96.12 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.413 175.492 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.406 HD11 ' HA2' ' A' ' 82' ' ' GLY . 97.3 mt -78.15 -32.38 50.24 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 -175.549 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -76.11 -28.18 57.39 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -77.64 -49.56 14.29 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.538 0.735 . . . . 0.0 110.421 173.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.426 ' O ' HG22 ' A' ' 102' ' ' THR . 2.2 p -144.86 96.59 5.04 Favored Pre-proline 0 CA--C 1.558 1.251 0 C-N-CA 124.703 1.201 . . . . 0.0 109.139 -178.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . 0.447 ' HG2' HD21 ' A' ' 16' ' ' LEU . 55.5 Cg_endo -73.45 -23.57 17.25 Favored 'Trans proline' 0 C--N 1.378 2.123 0 C-N-CA 122.542 2.162 . . . . 0.0 113.569 -179.056 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 46.5 p90 -81.95 -2.26 50.8 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -177.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.451 HG21 ' HG3' ' A' ' 95' ' ' ARG . 13.8 t -68.77 122.4 84.75 Favored Pre-proline 0 CA--C 1.558 1.279 0 CA-C-N 118.373 0.533 . . . . 0.0 110.708 -179.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.39 -27.72 18.95 Favored 'Trans proline' 0 C--N 1.371 1.735 0 C-N-CA 122.199 1.933 . . . . 0.0 111.782 173.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.411 ' HB2' ' HB2' ' A' ' 109' ' ' ALA . 12.7 m-85 -104.44 152.18 22.63 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.628 0.771 . . . . 0.0 110.735 -174.414 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.494 ' SG ' ' HB2' ' A' ' 108' ' ' CYS . 30.7 p -72.3 157.47 37.62 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 115.138 -0.937 . . . . 0.0 108.794 170.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.416 ' HB2' ' HD3' ' A' ' 95' ' ' ARG . 33.5 tt0 -51.1 -39.76 56.89 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.279 1.031 . . . . 0.0 112.16 -179.3 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -66.9 -48.32 69.08 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 124.182 0.993 . . . . 0.0 109.777 -177.074 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.494 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 85.0 m -82.54 -16.01 50.21 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 114.682 -1.145 . . . . 0.0 112.566 -174.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.411 ' HB2' ' HB2' ' A' ' 104' ' ' PHE . . . -85.23 -26.07 26.92 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.52 0.728 . . . . 0.0 109.942 171.249 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -77.59 -23.62 49.9 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.762 0.825 . . . . 0.0 110.175 170.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -72.91 -11.5 60.61 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.797 0.839 . . . . 0.0 111.738 174.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 69.9 mt . . . . . 0 CA--C 1.553 1.091 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 172.043 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 4.7 mp . . . . . 0 N--CA 1.483 1.202 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -160.67 139.21 10.08 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.49 0.716 . . . . 0.0 110.141 -177.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -90.57 10.54 74.28 Favored Glycine 0 C--N 1.343 0.933 0 O-C-N 123.573 0.546 . . . . 0.0 113.391 178.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 85.28 -63.78 4.29 Favored Glycine 0 C--N 1.351 1.391 0 C-N-CA 122.964 0.316 . . . . 0.0 113.268 176.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -140.94 -170.24 3.0 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.843 0.857 . . . . 0.0 110.648 -173.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.8 t 67.95 -176.04 0.2 Allowed 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 124.579 1.152 . . . . 0.0 110.043 -175.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . 0.456 ' SD ' HD12 ' A' ' 96' ' ' LEU . 49.1 ttp -73.07 79.65 1.22 Allowed 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 175.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -77.3 110.28 11.9 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.502 -170.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 55.4 t -66.54 -28.31 42.95 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 C-N-CA 123.408 0.683 . . . . 0.0 110.595 175.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -65.92 -38.9 89.88 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.968 0.907 . . . . 0.0 112.604 -176.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 60.3 p -64.48 -39.76 94.41 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 174.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -68.93 -32.56 72.26 Favored 'General case' 0 C--O 1.215 -0.74 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.184 177.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.552 ' HG2' HG21 ' A' ' 76' ' ' ILE . 1.4 tm-20 -60.31 -59.3 5.63 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.355 1.062 . . . . 0.0 109.374 -177.309 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt -66.81 -39.67 87.81 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 114.623 -1.171 . . . . 0.0 112.339 -174.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.461 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 12.5 tt -66.99 -38.43 81.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 -177.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.581 ' HB3' HG23 ' A' ' 69' ' ' ILE . 66.0 mt -67.84 -39.03 83.9 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 122.986 0.514 . . . . 0.0 111.368 178.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 38.3 mmt180 -61.93 -48.16 81.66 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.123 0.569 . . . . 0.0 110.439 178.165 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -62.48 -40.9 98.18 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.261 0.624 . . . . 0.0 110.78 178.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.482 ' HA ' ' HG2' ' A' ' 22' ' ' GLU . 6.3 mpt_? -72.02 -38.1 69.65 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.77 0.828 . . . . 0.0 112.151 -176.423 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.524 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.5 pt20 -68.56 -33.88 74.85 Favored 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.148 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.552 ' HG3' ' H ' ' A' ' 47' ' ' SER . 24.8 mmt180 -77.8 -30.3 51.21 Favored 'General case' 0 C--N 1.349 0.571 0 CA-C-O 118.972 -0.537 . . . . 0.0 112.159 -178.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.482 ' HG2' ' HA ' ' A' ' 19' ' ' ARG . 5.4 pt-20 -70.2 -33.82 72.17 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 174.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.57 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 88.1 mt -69.25 -47.58 64.28 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.404 172.315 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.464 ' O ' ' HB2' ' A' ' 28' ' ' HIS . 1.7 m-85 -56.88 -46.61 81.74 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.909 0.883 . . . . 0.0 111.137 -175.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.8 ptp180 -68.02 -37.0 80.89 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 122.96 0.504 . . . . 0.0 111.031 177.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.555 HH11 HD23 ' A' ' 23' ' ' LEU . 41.4 ttm180 -62.8 -43.08 99.73 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.037 0.935 . . . . 0.0 112.472 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 1.5 pp -94.67 -15.74 23.7 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.545 0.338 . . . . 0.0 111.836 -177.661 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.464 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 10.1 m170 -103.03 30.45 4.81 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 123.386 0.674 . . . . 0.0 109.434 168.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.52 ' HZ2' HD12 ' A' ' 30' ' ' ILE . 0.0 OUTLIER -52.21 -19.91 2.3 Favored 'General case' 0 N--CA 1.496 1.827 0 C-N-CA 126.093 1.757 . . . . 0.0 114.887 179.555 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.64 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.1 OUTLIER -84.59 -30.44 7.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 123.968 0.907 . . . . 0.0 111.238 -175.489 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -101.06 -30.31 11.67 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.25 0.62 . . . . 0.0 110.372 176.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -103.99 118.64 37.16 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.325 1.05 . . . . 0.0 108.176 -178.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -59.88 -28.83 67.88 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.383 0.673 . . . . 0.0 111.978 -175.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -77.62 81.69 4.06 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 123.342 0.657 . . . . 0.0 110.432 177.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -70.55 -47.72 58.95 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 168.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -86.72 126.19 64.57 Favored Pre-proline 0 CA--C 1.546 0.822 0 CA-C-N 113.736 -1.575 . . . . 0.0 108.208 169.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -58.45 102.9 0.14 Allowed 'Trans proline' 0 C--N 1.373 1.838 0 C-N-CA 122.848 2.365 . . . . 0.0 111.283 171.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 27.9 mmm180 -82.73 66.2 8.23 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 122.249 1.023 . . . . 0.0 109.972 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -160.86 106.32 1.28 Allowed Pre-proline 0 CA--C 1.549 0.915 0 CA-C-N 113.237 -1.802 . . . . 0.0 106.488 178.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -80.17 16.68 1.46 Allowed 'Trans proline' 0 C--N 1.374 1.889 0 C-N-CA 122.959 2.439 . . . . 0.0 113.452 -176.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -156.66 165.7 35.51 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.132 0.973 . . . . 0.0 108.721 -175.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -77.09 63.91 2.45 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 122.227 1.013 . . . . 0.0 109.385 167.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -65.88 -17.84 64.92 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-N 114.437 -1.256 . . . . 0.0 110.05 -176.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.7 t70 67.66 72.83 0.32 Allowed 'General case' 0 C--N 1.359 1.008 0 C-N-CA 125.123 1.369 . . . . 0.0 109.487 175.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 15.9 mmt180 -77.58 -44.57 28.0 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-N 113.984 -1.462 . . . . 0.0 109.693 173.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 47.31 65.4 1.27 Allowed 'General case' 0 C--N 1.364 1.209 0 O-C-N 124.858 1.349 . . . . 0.0 111.019 179.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.552 ' H ' ' HG3' ' A' ' 21' ' ' ARG . 14.5 m -57.62 123.1 14.45 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 114.533 -1.212 . . . . 0.0 111.823 -172.072 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.504 ' HB3' HH11 ' A' ' 49' ' ' ARG . 11.9 tp10 -72.76 170.76 13.94 Favored 'General case' 0 CA--C 1.555 1.165 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 173.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.504 HH11 ' HB3' ' A' ' 48' ' ' GLU . 6.9 mpt_? 69.14 78.79 0.21 Allowed 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.032 1.333 . . . . 0.0 108.892 -175.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.5 m -72.16 135.85 46.28 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.786 177.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 20.5 m120 -74.24 116.14 14.55 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 122.965 0.506 . . . . 0.0 111.008 -176.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -74.56 -39.09 62.49 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.661 0.784 . . . . 0.0 109.888 175.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -74.94 116.47 15.71 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.386 177.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 92.2 t -70.71 -53.81 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 123.101 0.56 . . . . 0.0 110.03 179.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 55.0 tp 70.81 137.52 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 124.905 1.282 . . . . 0.0 111.198 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -70.87 -18.16 62.7 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 123.401 0.68 . . . . 0.0 112.651 -171.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -79.62 25.56 0.33 Allowed 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 -170.231 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.478 HD22 HD13 ' A' ' 27' ' ' LEU . 6.2 mt -96.01 145.4 25.47 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 122.112 -0.368 . . . . 0.0 110.033 -178.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -79.18 151.17 34.62 Favored Glycine 0 C--N 1.348 1.242 0 CA-C-O 119.27 -0.739 . . . . 0.0 111.423 172.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -62.43 -51.67 66.62 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.26 0.624 . . . . 0.0 111.594 -176.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 8.4 p -60.74 -32.53 52.16 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 123.651 0.78 . . . . 0.0 111.21 175.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.523 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -60.5 -57.0 21.22 Favored Glycine 0 C--N 1.349 1.304 0 O-C-N 123.992 0.807 . . . . 0.0 111.439 175.542 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -63.41 -38.89 92.9 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 124.636 1.174 . . . . 0.0 111.473 -178.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -62.13 -53.25 57.98 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-N 114.85 -1.068 . . . . 0.0 109.66 -175.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -70.75 -34.23 71.64 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-N 114.044 -1.435 . . . . 0.0 109.874 -179.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.523 ' HB2' ' O ' ' A' ' 62' ' ' GLY . 14.8 tp -60.71 -53.51 56.58 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.699 1.2 . . . . 0.0 111.001 -178.121 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 80.5 ttt180 -76.16 -29.75 57.84 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 113.742 -1.572 . . . . 0.0 110.171 -173.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.4 -47.11 80.42 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.17 0.588 . . . . 0.0 110.263 173.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.581 HG23 ' HB3' ' A' ' 16' ' ' LEU . 74.7 mt -62.34 -48.19 89.51 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.661 175.444 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -68.8 -33.29 73.61 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.358 0.663 . . . . 0.0 110.374 -172.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.9 -41.45 74.69 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.382 0.673 . . . . 0.0 109.979 175.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.478 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -61.63 -41.44 97.48 Favored 'General case' 0 N--CA 1.481 1.115 0 O-C-N 123.882 0.739 . . . . 0.0 110.948 177.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.535 HD23 HD12 ' A' ' 76' ' ' ILE . 92.5 mt -67.93 -38.1 82.46 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.695 1.198 . . . . 0.0 111.53 177.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.67 -31.68 72.82 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.707 175.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -75.12 -33.64 61.59 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.748 0.819 . . . . 0.0 111.108 176.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.552 HG21 ' HG2' ' A' ' 13' ' ' GLU . 73.0 mt -63.33 -43.04 98.41 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 174.135 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.87 -41.02 99.23 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.166 175.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.433 ' HB3' HG22 ' A' ' 80' ' ' THR . 27.2 t -83.12 -6.64 59.56 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.86 0.864 . . . . 0.0 112.095 -175.075 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.63 26.19 73.55 Favored Glycine 0 C--N 1.354 1.569 0 CA-C-O 120.962 0.201 . . . . 0.0 112.814 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.433 HG22 ' HB3' ' A' ' 78' ' ' SER . 12.4 t -130.67 27.07 4.99 Favored 'General case' 0 CA--C 1.555 1.165 0 C-N-CA 124.59 1.156 . . . . 0.0 110.417 179.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -66.17 146.21 54.9 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 166.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.54 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 73.16 33.57 59.13 Favored Glycine 0 C--O 1.216 -0.998 0 O-C-N 123.667 0.604 . . . . 0.0 111.74 -174.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 88.2 m -122.09 146.69 46.96 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.337 0.655 . . . . 0.0 109.926 176.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 41.2 t -115.47 102.17 9.57 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.738 1.215 . . . . 0.0 109.082 176.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 27.3 m -65.49 -24.96 35.74 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 C-N-CA 123.887 0.875 . . . . 0.0 113.07 -174.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.546 ' HD2' ' HB3' ' A' ' 108' ' ' CYS . 22.0 ttmm -74.46 -11.05 60.13 Favored 'General case' 0 CA--C 1.559 1.312 0 C-N-CA 123.097 0.559 . . . . 0.0 112.249 -177.032 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 28.0 p -138.92 1.85 2.1 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.882 -0.511 . . . . 0.0 111.722 171.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 59.67 31.84 72.32 Favored Glycine 0 C--N 1.356 1.66 0 O-C-N 123.526 0.517 . . . . 0.0 114.179 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 50.4 mtpt -123.88 166.39 15.74 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-N 117.105 0.452 . . . . 0.0 111.215 -174.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.54 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 14.1 tpp180 -69.42 140.57 54.14 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 124.5 1.12 . . . . 0.0 110.876 -179.376 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 17.0 mm -75.54 150.67 6.6 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 123.762 0.825 . . . . 0.0 109.058 171.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 44.3 m -70.53 145.67 50.69 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 122.873 0.469 . . . . 0.0 109.769 173.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -58.75 -40.52 84.12 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.716 0.406 . . . . 0.0 110.05 174.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.481 ' HA ' ' HE3' ' A' ' 97' ' ' LYS . 36.4 m-20 -64.59 -32.9 74.75 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 114.964 -1.016 . . . . 0.0 111.454 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 4.8 tpm_? -70.72 -40.35 72.85 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.468 176.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.456 HD12 ' SD ' ' A' ' 7' ' ' MET . 98.8 mt -72.39 -35.73 68.5 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 123.598 0.561 . . . . 0.0 111.932 -177.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.481 ' HE3' ' HA ' ' A' ' 94' ' ' ASP . 15.7 ptpt -74.86 -29.72 61.11 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -77.79 -39.58 43.5 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.585 0.754 . . . . 0.0 111.099 176.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.5 p -157.37 96.27 2.06 Favored Pre-proline 0 CA--C 1.557 1.216 0 C-N-CA 124.53 1.132 . . . . 0.0 109.15 -177.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . 0.449 ' HG2' HD21 ' A' ' 16' ' ' LEU . 89.3 Cg_endo -78.53 -1.15 11.35 Favored 'Trans proline' 0 C--N 1.378 2.118 0 C-N-CA 122.796 2.331 . . . . 0.0 113.467 -179.454 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 27.1 p90 -108.6 9.81 27.19 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -178.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 12.7 t -76.78 118.47 71.96 Favored Pre-proline 0 CA--C 1.561 1.401 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 175.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -76.75 -6.34 16.78 Favored 'Trans proline' 0 C--N 1.376 1.977 0 C-N-CA 122.552 2.168 . . . . 0.0 112.377 178.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.536 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 33.0 m-85 -130.19 159.03 38.08 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.663 0.785 . . . . 0.0 109.899 -177.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 17.8 p -82.38 165.03 20.65 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 176.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.5 tm0? -49.19 -40.33 32.88 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.597 0.759 . . . . 0.0 111.712 -173.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -56.97 -54.23 49.0 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.643 0.777 . . . . 0.0 111.632 177.274 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.546 ' HB3' ' HD2' ' A' ' 86' ' ' LYS . 61.8 m -78.74 -22.14 46.96 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.56 -173.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -81.27 -33.05 32.95 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.789 0.835 . . . . 0.0 109.998 179.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -78.78 -20.26 50.26 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.674 0.79 . . . . 0.0 110.655 173.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -79.73 -17.43 53.57 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.669 0.787 . . . . 0.0 112.165 176.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 95.9 mt . . . . . 0 CA--C 1.554 1.127 0 CA-C-O 118.755 -0.64 . . . . 0.0 110.674 179.767 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 84.7 mt . . . . . 0 N--CA 1.48 1.053 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -162.88 98.68 0.97 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.509 0.724 . . . . 0.0 110.004 178.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -88.28 65.07 3.46 Favored Glycine 0 C--N 1.346 1.118 0 N-CA-C 111.533 -0.627 . . . . 0.0 111.533 176.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -141.61 110.13 0.62 Allowed Glycine 0 C--N 1.347 1.158 0 N-CA-C 111.815 -0.514 . . . . 0.0 111.815 -176.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -94.08 -24.08 17.72 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.531 0.732 . . . . 0.0 110.399 177.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 50.6 m -112.7 172.46 6.91 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.657 1.183 . . . . 0.0 109.374 173.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 13.5 ptm 48.17 37.83 8.84 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 125.853 1.661 . . . . 0.0 110.824 -173.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -50.13 101.15 0.03 OUTLIER 'General case' 0 C--N 1.364 1.213 0 CA-C-N 114.051 -1.431 . . . . 0.0 111.591 -169.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 59.1 t -56.67 -28.2 27.12 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.318 0 CA-C-N 114.174 -1.375 . . . . 0.0 112.028 -173.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.8 mp0 -62.85 -43.69 98.13 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 124.75 1.22 . . . . 0.0 111.117 -174.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.9 m -61.28 -44.91 96.46 Favored 'General case' 0 C--O 1.241 0.64 0 CA-C-N 114.757 -1.111 . . . . 0.0 109.936 175.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.516 ' HA ' HG22 ' A' ' 15' ' ' ILE . 27.8 m-85 -72.83 -29.99 63.67 Favored 'General case' 0 C--O 1.215 -0.733 0 CA-C-N 114.84 -1.073 . . . . 0.0 111.332 -178.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.486 ' HG2' HD13 ' A' ' 76' ' ' ILE . 3.4 tm-20 -65.42 -53.07 48.38 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 125.001 1.32 . . . . 0.0 109.002 -174.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.6 ptmm? -67.32 -43.17 82.29 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 114.81 -1.087 . . . . 0.0 111.603 -179.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.516 HG22 ' HA ' ' A' ' 12' ' ' TYR . 13.2 tt -69.54 -29.45 41.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 CA-C-O 120.779 0.324 . . . . 0.0 110.891 -174.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.447 ' HB3' HG23 ' A' ' 69' ' ' ILE . 41.0 mt -64.15 -46.65 83.12 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.736 171.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -64.25 -38.69 91.94 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 123.424 0.453 . . . . 0.0 111.274 178.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -58.66 -51.47 69.78 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.101 0.56 . . . . 0.0 109.661 177.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -64.53 -40.22 95.21 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 124.267 0.979 . . . . 0.0 111.189 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.526 ' HB2' HG21 ' A' ' 69' ' ' ILE . 3.9 tt0 -66.11 -44.62 83.78 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.268 0.627 . . . . 0.0 111.368 -179.109 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.515 ' O ' ' HG2' ' A' ' 25' ' ' ARG . 17.9 mmt180 -76.22 -36.0 58.78 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 119.101 -0.476 . . . . 0.0 111.07 -172.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -68.57 -38.45 80.73 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 123.684 0.615 . . . . 0.0 110.144 175.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.424 HD22 ' HA2' ' A' ' 62' ' ' GLY . 67.2 mt -67.18 -40.61 86.59 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 122.786 0.435 . . . . 0.0 110.674 175.018 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -55.41 -58.11 9.1 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 124.267 0.98 . . . . 0.0 109.964 -175.076 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.515 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 8.1 ptm180 -64.65 -34.73 78.97 Favored 'General case' 0 CA--C 1.559 1.316 0 O-C-N 124.036 0.835 . . . . 0.0 111.71 177.123 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -63.73 -41.22 98.08 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 123.784 0.834 . . . . 0.0 112.489 -178.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.686 HD21 HD22 ' A' ' 66' ' ' LEU . 4.3 pp -89.8 -23.7 21.66 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 122.88 0.472 . . . . 0.0 110.061 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 67.1 m-70 -86.18 32.91 0.61 Allowed 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.328 0.651 . . . . 0.0 109.99 167.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.8 pttp -58.96 -29.46 67.18 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 125.144 1.378 . . . . 0.0 111.925 174.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.526 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -65.12 -34.67 72.16 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.055 0 C-N-CA 123.409 0.683 . . . . 0.0 111.107 173.775 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -85.48 -25.41 26.9 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.061 0.944 . . . . 0.0 110.411 178.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -79.08 99.6 7.0 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.269 -0.878 . . . . 0.0 109.376 176.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -58.66 -45.13 90.01 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.61 0.764 . . . . 0.0 110.607 175.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -82.69 157.7 23.22 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-N 114.166 -1.379 . . . . 0.0 110.57 -175.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -74.73 1.44 12.39 Favored 'General case' 0 N--CA 1.488 1.445 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.422 171.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.502 ' HB3' ' NH2' ' A' ' 25' ' ' ARG . 90.6 mt-10 79.2 154.22 0.13 Allowed Pre-proline 0 C--N 1.358 0.973 0 C-N-CA 125.874 1.669 . . . . 0.0 112.733 167.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -57.52 122.14 11.25 Favored 'Trans proline' 0 C--N 1.382 2.303 0 C-N-CA 122.914 2.409 . . . . 0.0 112.42 173.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 74.2 mtp85 -76.88 -29.15 55.65 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.136 0.574 . . . . 0.0 109.869 170.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -76.18 148.24 80.81 Favored Pre-proline 0 N--CA 1.477 0.889 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.049 170.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -61.44 99.65 0.17 Allowed 'Trans proline' 0 C--N 1.378 2.123 0 C-N-CA 122.458 2.105 . . . . 0.0 111.076 177.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -158.49 96.59 1.41 Allowed 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.831 -171.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -174.52 -57.91 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 125.419 1.488 . . . . 0.0 107.357 163.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 36.56 69.05 0.22 Allowed 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 126.456 1.902 . . . . 0.0 113.983 176.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.491 ' HB3' ' HD2' ' A' ' 21' ' ' ARG . 16.6 t70 -87.78 127.53 35.32 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 174.279 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -130.44 25.51 5.12 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 174.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -112.42 -61.5 1.72 Allowed 'General case' 0 C--N 1.353 0.718 0 C-N-CA 123.548 0.739 . . . . 0.0 111.857 -170.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 71.6 p -76.87 100.91 5.7 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 122.918 0.487 . . . . 0.0 111.812 -169.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -85.83 100.06 11.8 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 171.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 31.5 mmm180 -123.42 146.72 47.78 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.654 0.782 . . . . 0.0 110.077 -178.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 37.5 m -87.04 114.88 24.03 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.673 0.789 . . . . 0.0 109.432 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -87.3 100.17 12.51 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.992 0.917 . . . . 0.0 111.769 -174.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -144.09 15.57 1.71 Allowed 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.485 0.714 . . . . 0.0 111.608 -175.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.758 ' HB2' HD11 ' A' ' 58' ' ' LEU . 3.5 mp0 -57.94 119.16 6.25 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.367 0.667 . . . . 0.0 109.875 -175.719 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 22.9 t -72.14 -11.6 15.1 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 123.992 0.917 . . . . 0.0 111.65 -169.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 63.9 tp -54.49 123.84 14.29 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 123.612 0.765 . . . . 0.0 111.434 176.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -71.77 -17.0 62.21 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.564 0.745 . . . . 0.0 111.717 -177.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -79.9 13.18 2.3 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.247 0.619 . . . . 0.0 112.666 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.758 HD11 ' HB2' ' A' ' 53' ' ' GLU . 18.2 mt -89.15 132.11 34.97 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 161.026 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -64.08 129.84 38.26 Favored Glycine 0 C--N 1.347 1.161 0 CA-C-O 119.244 -0.753 . . . . 0.0 111.483 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -63.84 -40.82 97.49 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.853 0.861 . . . . 0.0 112.235 -175.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 62.3 t -57.53 -39.23 68.07 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 C-N-CA 123.688 0.795 . . . . 0.0 109.518 173.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.544 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -63.87 -57.36 14.37 Favored Glycine 0 C--N 1.344 1.021 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.427 177.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.482 HE21 HD12 ' A' ' 58' ' ' LEU . 98.2 mt-30 -58.48 -42.86 88.51 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 124.966 1.306 . . . . 0.0 112.109 -175.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -70.19 -50.9 35.47 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.24 -173.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -62.78 -37.58 87.25 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.421 178.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.686 HD22 HD21 ' A' ' 27' ' ' LEU . 10.4 tp -58.27 -49.53 76.79 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.951 1.301 . . . . 0.0 109.963 178.368 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -66.74 -33.83 76.5 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.925 -176.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.34 -35.02 75.49 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.522 0.729 . . . . 0.0 110.571 175.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.526 HG21 ' HB2' ' A' ' 20' ' ' GLN . 97.3 mt -68.36 -54.21 23.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 123.731 0.813 . . . . 0.0 110.314 176.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -59.53 -32.14 70.04 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 124.918 1.287 . . . . 0.0 112.11 178.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.477 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -65.14 -46.61 80.24 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.303 0.641 . . . . 0.0 109.647 174.142 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.468 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -69.01 -36.18 77.5 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.702 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.576 HD23 HD12 ' A' ' 76' ' ' ILE . 73.8 mt -71.2 -34.06 70.52 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 124.165 0.986 . . . . 0.0 110.163 177.605 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.85 -36.77 85.01 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.131 173.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.477 ' HG2' ' O ' ' A' ' 71' ' ' ALA . 4.9 mmp_? -67.5 -35.96 80.14 Favored 'General case' 0 C--O 1.216 -0.707 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.839 175.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.576 HD12 HD23 ' A' ' 73' ' ' LEU . 64.7 mt -68.47 -43.34 83.97 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 CA-C-O 121.031 0.443 . . . . 0.0 110.385 179.004 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.7 -28.71 68.65 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.22 177.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.5 t -87.54 -15.9 36.17 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.786 0.834 . . . . 0.0 111.321 175.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 82.22 5.64 89.46 Favored Glycine 0 C--N 1.35 1.333 0 C-N-CA 123.187 0.422 . . . . 0.0 113.992 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.434 HG23 ' HD3' ' A' ' 75' ' ' ARG . 13.3 t -109.89 30.07 7.04 Favored 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 124.369 1.067 . . . . 0.0 110.538 -177.053 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.453 ' HE1' ' HB1' ' A' ' 72' ' ' ALA . 79.7 t80 -63.99 147.68 51.46 Favored 'General case' 0 N--CA 1.479 0.981 0 O-C-N 121.958 -0.464 . . . . 0.0 111.38 171.054 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 71.07 42.57 58.71 Favored Glycine 0 C--N 1.347 1.184 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.263 -175.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 98.0 m -129.61 122.28 28.77 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.34 1.056 . . . . 0.0 110.152 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.451 ' HB2' ' HB3' ' A' ' 105' ' ' CYS . 47.3 t -76.49 100.12 5.15 Favored 'General case' 0 C--N 1.351 0.649 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 170.513 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 35.4 m -60.38 -29.06 43.51 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 O-C-N 124.318 1.011 . . . . 0.0 111.628 177.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.503 ' HD3' ' SG ' ' A' ' 108' ' ' CYS . 47.6 tttm -77.23 -6.28 52.48 Favored 'General case' 0 CA--C 1.56 1.351 0 C-N-CA 124.296 1.038 . . . . 0.0 111.665 -177.392 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 63.1 m -124.26 -33.96 2.99 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.981 0.913 . . . . 0.0 112.37 177.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 87.31 6.5 78.0 Favored Glycine 0 CA--C 1.537 1.415 0 N-CA-C 111.874 -0.49 . . . . 0.0 111.874 -160.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -96.34 -172.21 2.47 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.379 1.071 . . . . 0.0 111.233 -174.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 26.6 mmt85 -91.45 163.05 14.31 Favored 'General case' 0 C--O 1.244 0.791 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.467 169.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 20.1 mm -92.45 142.95 12.36 Favored 'Isoleucine or valine' 0 C--O 1.244 0.767 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 163.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 44.2 m -68.29 144.16 54.95 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 175.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -61.02 -36.45 79.55 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 122.625 0.37 . . . . 0.0 110.169 174.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -59.15 -40.88 86.92 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.304 1.042 . . . . 0.0 110.332 175.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.414 ' HE ' ' HA ' ' A' ' 95' ' ' ARG . 0.2 OUTLIER -71.37 -38.16 71.57 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.559 177.056 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 73.2 mt -70.44 -35.42 73.36 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.613 0.765 . . . . 0.0 112.031 -177.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -79.24 -27.45 42.41 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -78.97 -27.88 43.54 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.004 0.922 . . . . 0.0 111.231 174.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.9 p -170.86 99.3 0.42 Allowed Pre-proline 0 CA--C 1.561 1.367 0 C-N-CA 124.937 1.295 . . . . 0.0 109.212 -178.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -75.55 -12.59 20.45 Favored 'Trans proline' 0 C--N 1.375 1.924 0 C-N-CA 122.366 2.044 . . . . 0.0 112.675 176.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 12.6 p90 -101.86 57.89 0.83 Allowed 'General case' 0 C--O 1.24 0.587 0 C-N-CA 124.215 1.006 . . . . 0.0 109.599 -179.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 11.9 t -131.88 117.26 16.09 Favored Pre-proline 0 CA--C 1.552 1.057 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.876 174.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -77.4 -4.77 15.05 Favored 'Trans proline' 0 C--N 1.375 1.923 0 C-N-CA 122.65 2.233 . . . . 0.0 112.134 171.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.449 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 16.2 m-85 -116.02 138.5 51.16 Favored 'General case' 0 C--N 1.353 0.753 0 C-N-CA 123.932 0.893 . . . . 0.0 110.369 -173.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.494 ' SG ' ' HB2' ' A' ' 107' ' ' GLU . 22.0 p -72.64 168.97 17.57 Favored 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 174.157 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -52.94 -37.75 61.27 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.802 0.841 . . . . 0.0 111.861 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.494 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 24.8 mt-10 -54.82 -53.47 54.77 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 124.211 1.004 . . . . 0.0 110.63 176.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.503 ' SG ' ' HD3' ' A' ' 86' ' ' LYS . 87.8 m -71.39 -38.59 71.48 Favored 'General case' 0 C--O 1.214 -0.775 0 CA-C-N 114.563 -1.199 . . . . 0.0 111.28 -176.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.95 -21.35 66.82 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.35 0.66 . . . . 0.0 111.216 176.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -85.07 -31.41 23.4 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.493 0.717 . . . . 0.0 111.291 172.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -133.31 81.48 1.93 Allowed 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.517 0.727 . . . . 0.0 111.28 -176.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 97.9 mt . . . . . 0 N--CA 1.484 1.233 0 C-N-CA 123.764 0.825 . . . . 0.0 109.383 171.876 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.3 mp . . . . . 0 N--CA 1.484 1.241 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -150.21 148.68 29.21 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.682 0.793 . . . . 0.0 109.913 179.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -174.72 -147.98 6.42 Favored Glycine 0 C--N 1.341 0.823 0 N-CA-C 111.772 -0.531 . . . . 0.0 111.772 -178.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.8 -26.08 72.27 Favored Glycine 0 C--N 1.351 1.377 0 C-N-CA 122.892 0.282 . . . . 0.0 113.32 -178.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -97.49 -67.81 0.83 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.648 0.779 . . . . 0.0 109.714 178.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 54.9 m -72.76 98.78 2.47 Favored 'General case' 0 C--N 1.349 0.552 0 C-N-CA 123.429 0.692 . . . . 0.0 110.04 -177.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 25.5 ptm -62.74 -40.05 96.01 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 123.205 0.602 . . . . 0.0 109.387 171.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.3 t30 52.49 101.35 0.01 OUTLIER 'General case' 0 C--N 1.357 0.894 0 C-N-CA 126.24 1.816 . . . . 0.0 111.555 -178.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 39.8 t -61.32 -26.94 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.407 178.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -62.63 -40.54 97.3 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 124.305 1.042 . . . . 0.0 110.691 175.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.5 m -59.27 -44.18 92.46 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 121.052 0.453 . . . . 0.0 110.406 175.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -71.38 -32.5 68.54 Favored 'General case' 0 C--N 1.347 0.494 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.738 -179.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -62.49 -57.0 12.76 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.182 0.993 . . . . 0.0 109.292 -179.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 18.2 ptmt -66.76 -39.28 87.82 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 123.899 0.75 . . . . 0.0 112.404 -174.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 14.0 tt -63.37 -34.37 66.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 -179.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.509 ' HB3' HG23 ' A' ' 69' ' ' ILE . 80.4 mt -70.61 -33.67 71.29 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 122.927 0.491 . . . . 0.0 111.843 175.577 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.02 -46.24 85.35 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 122.964 0.505 . . . . 0.0 109.733 176.383 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -60.95 -49.94 75.43 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.775 0.83 . . . . 0.0 111.062 176.208 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.462 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 3.5 mpt_? -66.0 -37.3 85.57 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 115.168 -0.923 . . . . 0.0 111.778 -174.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.615 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.5 pt20 -70.72 -40.64 72.7 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 117.996 0.362 . . . . 0.0 110.389 -177.667 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.43 ' HD2' ' HD3' ' A' ' 45' ' ' ARG . 91.5 mtt-85 -79.39 -30.31 42.42 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 112.427 0.528 . . . . 0.0 112.427 -175.076 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -68.4 -31.06 70.15 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 172.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.492 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 97.7 mt -66.89 -51.34 56.58 Favored 'General case' 0 C--N 1.352 0.709 0 CA-C-O 119.113 -0.47 . . . . 0.0 110.232 170.326 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -49.83 -51.67 38.18 Favored 'General case' 0 N--CA 1.483 1.209 0 O-C-N 124.303 1.002 . . . . 0.0 111.923 -177.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.421 ' HB2' ' O ' ' A' ' 34' ' ' PHE . 7.3 ptp85 -64.63 -38.66 91.77 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 123.306 0.379 . . . . 0.0 111.248 177.131 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -65.16 -33.53 76.24 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.581 0.752 . . . . 0.0 112.322 -177.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 4.1 pp -103.39 -17.03 15.43 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -175.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 71.4 m-70 -87.62 18.27 4.09 Favored 'General case' 0 N--CA 1.486 1.33 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 167.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -47.87 -32.49 6.27 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 126.341 1.856 . . . . 0.0 114.23 176.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.551 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.1 OUTLIER -67.68 -26.97 36.53 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.227 0 C-N-CA 124.334 1.054 . . . . 0.0 112.65 -177.381 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -116.3 -17.4 10.76 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.821 0.848 . . . . 0.0 111.117 -179.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -122.87 124.01 42.28 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.169 0.987 . . . . 0.0 109.628 -173.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -89.67 12.6 16.41 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.582 0.753 . . . . 0.0 110.934 177.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.421 ' O ' ' HB2' ' A' ' 25' ' ' ARG . 86.8 m-85 -97.11 99.69 11.18 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 124.606 1.163 . . . . 0.0 109.768 -172.567 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -105.35 -44.3 4.76 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.531 0.733 . . . . 0.0 109.766 175.184 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 65.86 167.77 0.11 Allowed Pre-proline 0 CA--C 1.572 1.79 0 C-N-CA 124.26 1.024 . . . . 0.0 111.816 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.505 ' HD2' ' HB2' ' A' ' 41' ' ' ASP . 53.3 Cg_exo -57.72 -165.02 0.02 OUTLIER 'Trans proline' 0 C--N 1.388 2.645 0 C-N-CA 123.286 2.657 . . . . 0.0 115.107 172.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 39.1 mmt180 -65.18 -37.73 88.27 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.283 0.633 . . . . 0.0 110.611 174.254 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -79.15 150.08 73.92 Favored Pre-proline 0 CA--C 1.548 0.883 0 CA-C-N 115.078 -0.965 . . . . 0.0 108.735 168.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -62.75 -22.85 74.28 Favored 'Trans proline' 0 C--N 1.379 2.139 0 C-N-CA 122.399 2.066 . . . . 0.0 112.987 -176.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.505 ' HB2' ' HD2' ' A' ' 37' ' ' PRO . 24.6 t70 77.1 -51.15 0.56 Allowed 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 125.923 1.689 . . . . 0.0 112.736 174.335 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -52.29 118.11 3.3 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.186 0.995 . . . . 0.0 110.765 177.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -59.06 -58.22 9.61 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.524 0.73 . . . . 0.0 110.355 -174.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -84.3 144.19 29.04 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 165.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.43 ' HD3' ' HD2' ' A' ' 21' ' ' ARG . 59.3 ttm-85 -66.96 86.85 0.14 Allowed 'General case' 0 CA--C 1.553 1.083 0 O-C-N 124.084 0.865 . . . . 0.0 111.05 -174.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.05 122.79 24.08 Favored 'General case' 0 C--O 1.244 0.765 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.878 -175.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 40.2 m -143.22 -71.82 0.3 Allowed 'General case' 0 C--O 1.244 0.773 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 176.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 53.36 -168.59 0.05 Allowed 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 124.211 1.004 . . . . 0.0 111.172 -170.408 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 11.8 mtm-85 61.07 -170.01 0.16 Allowed 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.295 0.638 . . . . 0.0 111.974 173.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.4 p -170.9 -52.24 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.844 0.857 . . . . 0.0 109.171 174.002 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 66.43 108.5 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.538 1.535 . . . . 0.0 111.157 178.063 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -69.6 -34.83 74.67 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.45 0.7 . . . . 0.0 110.84 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -63.05 123.98 19.96 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 123.565 0.541 . . . . 0.0 110.482 -179.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 98.9 t -66.16 -47.13 85.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 O-C-N 123.864 0.728 . . . . 0.0 109.762 -178.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 35.8 tp 67.1 117.62 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 125.105 1.362 . . . . 0.0 111.773 175.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -72.19 -15.94 61.96 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.593 0.757 . . . . 0.0 112.05 -175.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -71.25 -85.41 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 122.528 0.331 . . . . 0.0 110.2 178.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.437 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 59.3 mt 31.06 -89.21 0.0 OUTLIER 'General case' 0 CA--C 1.558 1.267 0 C-N-CA 126.388 1.875 . . . . 0.0 114.423 -172.505 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 159.41 101.69 0.17 Allowed Glycine 0 C--N 1.342 0.91 0 N-CA-C 110.149 -1.18 . . . . 0.0 110.149 -172.029 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -48.16 -53.33 17.15 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 124.552 1.141 . . . . 0.0 113.363 -168.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.48 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 95.1 t -57.59 -44.1 84.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 O-C-N 124.061 0.851 . . . . 0.0 110.425 -179.353 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -67.97 -33.36 79.14 Favored Glycine 0 C--N 1.347 1.179 0 O-C-N 123.98 0.8 . . . . 0.0 113.394 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -72.08 -43.67 64.47 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.521 0.728 . . . . 0.0 110.62 -179.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -70.22 -35.73 74.06 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.867 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.48 ' HB2' ' O ' ' A' ' 61' ' ' VAL . 2.1 tp10 -66.39 -47.56 72.92 Favored 'General case' 0 C--N 1.349 0.554 0 CA-C-N 114.866 -1.061 . . . . 0.0 109.145 179.362 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 10.5 mt -51.33 -46.82 62.77 Favored 'General case' 0 N--CA 1.482 1.134 0 O-C-N 124.544 1.153 . . . . 0.0 110.999 173.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -64.01 -36.77 85.08 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.644 -176.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -74.76 -33.71 62.36 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.843 0.857 . . . . 0.0 111.469 177.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.615 HG21 ' HB3' ' A' ' 20' ' ' GLN . 69.9 mt -69.16 -55.85 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.782 0.833 . . . . 0.0 110.078 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -66.59 -21.91 66.13 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.567 1.147 . . . . 0.0 112.221 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.82 -49.81 71.4 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 121.275 0.559 . . . . 0.0 109.818 170.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.467 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -66.59 -41.51 88.37 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.244 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.433 HD21 ' HB2' ' A' ' 16' ' ' LEU . 79.6 mt -63.36 -41.26 98.82 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 124.386 1.074 . . . . 0.0 111.707 178.669 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.18 -40.17 84.81 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.762 0.825 . . . . 0.0 110.347 174.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 79.5 mtt85 -76.07 -23.11 55.01 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 115.087 -0.96 . . . . 0.0 112.731 -179.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 72' ' ' ALA . 85.3 mt -71.68 -44.34 69.45 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 173.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.42 -33.13 75.02 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.753 176.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 26.0 t -83.17 -19.35 36.75 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.67 0.788 . . . . 0.0 111.279 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 84.83 10.26 79.34 Favored Glycine 0 C--N 1.349 1.281 0 C-N-CA 122.924 0.297 . . . . 0.0 113.747 179.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.7 t -113.84 30.81 6.98 Favored 'General case' 0 CA--C 1.558 1.269 0 C-N-CA 123.92 0.888 . . . . 0.0 110.441 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -67.37 147.29 53.12 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 122.014 -0.429 . . . . 0.0 110.41 171.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.484 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 74.61 44.61 25.77 Favored Glycine 0 C--N 1.345 1.068 0 O-C-N 123.551 0.532 . . . . 0.0 111.823 -177.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 85.5 m -123.13 123.01 39.86 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.7 0.8 . . . . 0.0 110.366 179.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 22.4 t -70.34 89.51 0.67 Allowed 'General case' 0 C--N 1.353 0.735 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 170.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 15.2 m -63.56 -30.27 49.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.832 0.853 . . . . 0.0 112.3 -169.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 57.1 tttm -69.23 -20.2 63.95 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.203 1.001 . . . . 0.0 111.128 179.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 7.0 m -119.49 -16.47 8.9 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.089 0.955 . . . . 0.0 111.386 -173.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 65.54 21.6 68.97 Favored Glycine 0 CA--C 1.539 1.562 0 C-N-CA 122.937 0.303 . . . . 0.0 112.956 -168.148 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -104.35 -170.2 1.73 Allowed 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.582 1.153 . . . . 0.0 110.987 -174.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.484 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 13.2 tpp180 -91.7 154.88 18.69 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.347 1.059 . . . . 0.0 110.494 178.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 31.8 mm -98.05 149.34 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 168.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.7 m -73.97 145.43 44.65 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.833 0.853 . . . . 0.0 109.526 175.121 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.424 ' HG2' ' HZ3' ' A' ' 97' ' ' LYS . 33.5 tt0 -62.63 -30.84 71.66 Favored 'General case' 0 N--CA 1.482 1.125 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 174.596 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.528 ' HA ' ' HE2' ' A' ' 97' ' ' LYS . 17.7 m-20 -62.36 -41.75 98.85 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.297 1.039 . . . . 0.0 111.295 175.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.435 ' HG3' HG21 ' A' ' 102' ' ' THR . 21.9 tpt180 -68.71 -40.55 79.91 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.1 176.766 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 94.4 mt -71.44 -32.24 68.11 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.152 0.581 . . . . 0.0 112.41 -177.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.528 ' HE2' ' HA ' ' A' ' 94' ' ' ASP . 0.2 OUTLIER -78.13 -32.2 50.29 Favored 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -179.502 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.37 -41.33 56.63 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.003 0.921 . . . . 0.0 110.737 176.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.4 p -153.45 98.48 2.7 Favored Pre-proline 0 CA--C 1.556 1.175 0 C-N-CA 124.906 1.282 . . . . 0.0 108.803 -176.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_exo -68.73 -24.93 34.26 Favored 'Trans proline' 0 C--N 1.371 1.756 0 C-N-CA 122.584 2.189 . . . . 0.0 112.28 173.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 9.1 p90 -89.53 58.63 4.43 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.652 1.181 . . . . 0.0 109.988 -178.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.435 HG21 ' HG3' ' A' ' 95' ' ' ARG . 10.9 t -123.83 104.15 33.44 Favored Pre-proline 0 CA--C 1.559 1.294 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.684 -175.143 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -67.35 -36.63 20.09 Favored 'Trans proline' 0 C--N 1.378 2.126 0 C-N-CA 122.474 2.116 . . . . 0.0 111.839 174.191 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -99.69 174.73 6.09 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -178.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.555 ' SG ' ' HB2' ' A' ' 108' ' ' CYS . 24.9 p -98.38 179.09 4.83 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.343 0.657 . . . . 0.0 109.301 176.243 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -54.52 -56.88 14.34 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.739 0.816 . . . . 0.0 111.768 -179.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -69.32 -39.67 78.07 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.933 -176.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.555 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 80.6 m -78.66 -21.8 47.76 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -176.075 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -76.21 -33.12 59.26 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 171.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.87 -23.12 59.55 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.648 172.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.439 ' HB3' ' HA ' ' A' ' 108' ' ' CYS . . . -102.42 18.69 20.47 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.28 1.032 . . . . 0.0 112.048 -176.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 82.5 mt . . . . . 0 N--CA 1.482 1.141 0 C-N-CA 122.907 0.483 . . . . 0.0 110.478 175.255 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.5 mp . . . . . 0 N--CA 1.481 1.109 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -155.09 116.73 4.07 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.485 0.714 . . . . 0.0 110.197 175.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 138.77 -126.4 3.4 Favored Glycine 0 C--N 1.346 1.09 0 N-CA-C 110.986 -0.846 . . . . 0.0 110.986 178.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 75.37 -81.66 0.94 Allowed Glycine 0 C--N 1.348 1.238 0 N-CA-C 111.693 -0.563 . . . . 0.0 111.693 178.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -96.32 -12.55 24.28 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.977 0.911 . . . . 0.0 110.802 176.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 66.8 m -104.19 169.02 8.73 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.498 0.719 . . . . 0.0 109.412 170.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 61.4 ttp -63.03 120.93 12.36 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 178.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -75.66 72.07 2.59 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.056 0.942 . . . . 0.0 111.845 -174.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 21.9 t -70.7 -29.1 36.58 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 CA-C-N 115.344 -0.844 . . . . 0.0 109.791 176.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -68.77 -38.07 79.8 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.668 0.787 . . . . 0.0 111.183 178.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 27.8 m -63.45 -37.99 89.43 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.815 174.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.413 ' HA ' HG22 ' A' ' 15' ' ' ILE . 21.0 m-85 -70.8 -34.22 71.52 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.861 175.665 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.495 ' HG2' HG21 ' A' ' 76' ' ' ILE . 4.7 mm-40 -55.42 -59.23 5.1 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 124.107 0.963 . . . . 0.0 109.963 178.749 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.2 ptmt -66.82 -45.64 77.67 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.858 -174.234 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.51 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 12.3 tt -64.3 -36.04 75.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 CA-C-N 117.861 0.301 . . . . 0.0 110.624 -174.354 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.596 ' HB3' HG23 ' A' ' 69' ' ' ILE . 63.1 mt -66.67 -38.08 86.08 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.227 0.611 . . . . 0.0 110.82 176.597 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.45 ' HA ' ' HG2' ' A' ' 20' ' ' GLN . 96.2 mtt-85 -72.18 -26.08 61.93 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 123.513 0.508 . . . . 0.0 111.57 178.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 53.5 m-20 -74.2 -40.06 62.73 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 122.872 0.469 . . . . 0.0 110.305 173.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.51 ' HD2' ' O ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -67.22 -40.13 86.35 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.416 177.183 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.624 ' HB3' HG21 ' A' ' 69' ' ' ILE . 1.3 pt20 -71.37 -31.07 66.89 Favored 'General case' 0 C--O 1.204 -1.303 0 CA-C-O 118.906 -0.569 . . . . 0.0 109.691 178.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -56.2 -54.58 43.54 Favored 'General case' 0 N--CA 1.496 1.862 0 CA-C-N 118.618 0.645 . . . . 0.0 110.548 174.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -67.9 -35.22 78.11 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.857 -176.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.543 ' HA ' ' HG2' ' A' ' 26' ' ' ARG . 97.8 mt -69.11 -50.62 46.44 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 122.792 0.437 . . . . 0.0 111.396 176.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -51.24 -46.0 62.18 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 124.513 1.125 . . . . 0.0 111.026 -178.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.1 ptm180 -75.17 -32.61 61.32 Favored 'General case' 0 CA--C 1.549 0.923 0 O-C-N 123.428 0.455 . . . . 0.0 111.779 -179.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.543 ' HG2' ' HA ' ' A' ' 23' ' ' LEU . 6.3 ptm180 -74.01 -27.27 60.88 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-N 118.075 0.398 . . . . 0.0 111.417 -177.614 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.0 pp -89.56 -31.99 17.35 Favored 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 110.04 -0.355 . . . . 0.0 110.04 176.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 55.4 m-70 -86.02 29.78 0.71 Allowed 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.146 0.578 . . . . 0.0 110.276 169.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 18.3 pttp -50.61 -37.12 38.47 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 125.378 1.471 . . . . 0.0 112.619 176.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.504 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -61.55 -29.83 46.91 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.081 0 C-N-CA 124.142 0.977 . . . . 0.0 111.86 178.022 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.436 ' HG2' HG12 ' A' ' 30' ' ' ILE . 30.3 mm-40 -96.97 -29.45 13.66 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.445 1.098 . . . . 0.0 110.877 177.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -91.83 66.46 5.14 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 122.211 1.005 . . . . 0.0 110.803 -171.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -79.78 -16.37 55.67 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-N 114.127 -1.397 . . . . 0.0 109.218 170.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -60.14 114.77 3.04 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.869 1.268 . . . . 0.0 110.735 178.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.421 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 16.8 tp10 -83.93 -19.83 34.01 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.435 0.694 . . . . 0.0 111.269 -177.391 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.421 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 4.1 pt-20 66.76 155.06 0.13 Allowed Pre-proline 0 N--CA 1.493 1.723 0 C-N-CA 125.97 1.708 . . . . 0.0 111.933 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -71.45 -86.85 0.0 OUTLIER 'Trans proline' 0 C--N 1.373 1.844 0 C-N-CA 121.601 1.534 . . . . 0.0 109.543 163.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 64.1 mtm-85 -141.09 17.01 2.27 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 124.556 1.142 . . . . 0.0 108.912 171.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -164.07 108.81 0.91 Allowed Pre-proline 0 CA--C 1.552 1.035 0 C-N-CA 124.311 1.045 . . . . 0.0 109.471 -172.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -96.41 6.17 1.75 Allowed 'Trans proline' 0 C--N 1.375 1.946 0 C-N-CA 123.02 2.48 . . . . 0.0 111.893 170.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -166.36 115.18 0.92 Allowed 'General case' 0 C--N 1.353 0.731 0 C-N-CA 124.374 1.07 . . . . 0.0 108.935 -177.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -100.73 38.15 1.58 Allowed 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.025 0.93 . . . . 0.0 109.612 178.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 60.78 61.33 1.7 Allowed 'General case' 0 C--O 1.242 0.695 0 C-N-CA 124.141 0.977 . . . . 0.0 108.63 -170.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.12 -26.94 66.05 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 114.409 -1.268 . . . . 0.0 110.379 175.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 65.14 50.75 1.77 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.683 1.193 . . . . 0.0 108.758 178.751 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -79.96 87.72 5.37 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-N 114.399 -1.273 . . . . 0.0 108.445 171.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 16.2 p -77.4 75.7 3.95 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-O 121.833 0.825 . . . . 0.0 110.244 -178.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -157.8 112.12 2.6 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.147 -1.388 . . . . 0.0 108.013 -179.316 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.518 ' HD2' HD21 ' A' ' 51' ' ' ASN . 14.1 ptt180 -86.13 169.56 13.0 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.679 0.792 . . . . 0.0 110.077 179.247 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 62.0 p -150.3 50.09 0.9 Allowed 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.036 0.534 . . . . 0.0 110.339 179.123 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.518 HD21 ' HD2' ' A' ' 49' ' ' ARG . 12.1 p30 -106.68 -171.17 1.84 Allowed 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 123.284 0.634 . . . . 0.0 110.013 175.526 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 35.0 t70 64.06 32.24 12.97 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 124.458 1.103 . . . . 0.0 110.194 178.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.4 ' HB2' HD11 ' A' ' 58' ' ' LEU . 41.7 mt-10 -90.54 142.78 27.39 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.025 -175.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 26.4 t -85.7 -8.33 11.11 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.263 0 C-N-CA 123.684 0.794 . . . . 0.0 110.789 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 34.8 tp -58.06 120.71 9.05 Favored 'General case' 0 C--N 1.36 1.037 0 C-N-CA 123.252 0.621 . . . . 0.0 111.29 -177.042 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -77.35 -15.56 59.33 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.73 0.812 . . . . 0.0 111.473 -177.326 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -79.91 5.95 12.48 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.354 0.662 . . . . 0.0 112.61 177.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.421 HD12 HE21 ' A' ' 63' ' ' GLN . 35.9 mt -86.16 142.67 28.47 Favored 'General case' 0 C--O 1.241 0.652 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 169.465 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -65.14 142.48 44.77 Favored Glycine 0 C--N 1.347 1.185 0 CA-C-O 119.524 -0.598 . . . . 0.0 112.309 178.267 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -58.34 -50.78 72.4 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.311 1.044 . . . . 0.0 111.286 -179.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 11.2 p -61.89 -33.66 59.06 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.261 177.042 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -67.23 -51.84 35.64 Favored Glycine 0 C--N 1.347 1.16 0 O-C-N 123.905 0.753 . . . . 0.0 112.443 -178.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.421 HE21 HD12 ' A' ' 58' ' ' LEU . 99.5 mt-30 -62.33 -43.87 97.82 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.06 0.944 . . . . 0.0 111.162 -179.581 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -65.27 -48.04 74.6 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.973 -177.18 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -77.35 -27.38 52.69 Favored 'General case' 0 C--O 1.216 -0.669 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.83 -175.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.3 mp -59.72 -47.19 86.62 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-O 121.544 0.688 . . . . 0.0 109.286 169.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 40.0 ttt180 -60.57 -37.56 81.7 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 114.33 -1.304 . . . . 0.0 110.318 -178.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.33 -39.72 59.14 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.191 0.997 . . . . 0.0 111.741 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.624 HG21 ' HB3' ' A' ' 20' ' ' GLN . 67.8 mt -74.68 -57.87 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 123.713 0.805 . . . . 0.0 110.274 -177.288 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -56.2 -33.54 65.42 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.218 1.007 . . . . 0.0 111.79 177.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.444 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -63.53 -51.33 65.92 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 110.269 -0.271 . . . . 0.0 110.269 171.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.481 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -58.57 -44.78 89.87 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.942 0.897 . . . . 0.0 111.588 -177.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.431 HD21 ' HB2' ' A' ' 16' ' ' LEU . 95.8 mt -64.68 -38.43 90.96 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 124.745 1.218 . . . . 0.0 111.463 179.13 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.75 -33.38 74.74 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.728 176.302 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.451 ' NH1' HG11 ' A' ' 85' ' ' VAL . 79.8 mtt-85 -74.84 -25.49 59.03 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.511 0.724 . . . . 0.0 111.051 177.181 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.495 HG21 ' HG2' ' A' ' 13' ' ' GLU . 82.7 mt -70.91 -46.43 68.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 172.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.36 -25.79 68.19 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.861 0.864 . . . . 0.0 111.347 176.359 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.9 t -83.9 -29.57 27.07 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.941 0.896 . . . . 0.0 111.133 174.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 84.94 14.8 68.82 Favored Glycine 0 C--N 1.349 1.297 0 C-N-CA 123.034 0.35 . . . . 0.0 113.421 -176.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 15.3 t -106.13 7.57 31.74 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 123.809 0.844 . . . . 0.0 110.819 178.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -67.55 145.47 54.87 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 171.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.413 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 83.68 12.91 76.8 Favored Glycine 0 C--N 1.344 0.972 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.864 -171.19 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 43.4 m -130.39 119.18 22.34 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.217 1.007 . . . . 0.0 109.792 175.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 41.9 t -64.28 100.56 0.35 Allowed 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.9 0.88 . . . . 0.0 109.314 171.361 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.451 HG11 ' NH1' ' A' ' 75' ' ' ARG . 24.9 m -67.4 -23.61 30.34 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.918 0 C-N-CA 123.841 0.856 . . . . 0.0 111.782 -179.616 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 42.4 tttm -70.48 -17.56 62.97 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.598 0.759 . . . . 0.0 110.86 174.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 54.3 m -112.14 -29.39 7.6 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 124.295 1.038 . . . . 0.0 111.811 177.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 69.4 22.24 76.31 Favored Glycine 0 CA--C 1.539 1.58 0 CA-C-N 116.176 -0.465 . . . . 0.0 112.406 -162.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -126.09 174.38 8.52 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 124.674 1.19 . . . . 0.0 109.209 -174.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.413 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 13.3 tpp180 -67.04 158.23 31.53 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 124.708 1.203 . . . . 0.0 112.629 -173.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 13.1 mm -100.19 146.37 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 N-CA-C 107.786 -1.191 . . . . 0.0 107.786 164.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.7 m -72.36 140.97 48.75 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 173.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -63.72 -29.25 70.49 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 175.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -55.66 -49.68 72.25 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.658 1.183 . . . . 0.0 110.117 173.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.474 ' HG3' HG21 ' A' ' 102' ' ' THR . 26.2 tpt180 -62.19 -46.41 89.04 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 113.907 -1.497 . . . . 0.0 110.804 178.407 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 97.1 mt -66.22 -39.74 89.81 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.538 0.735 . . . . 0.0 112.087 -175.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -74.87 -32.03 61.76 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 122.353 0.261 . . . . 0.0 110.435 -176.221 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -79.3 -43.16 24.19 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.645 0.778 . . . . 0.0 111.192 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.1 p -148.2 95.32 4.12 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 124.724 1.21 . . . . 0.0 108.473 -177.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -79.64 -6.5 14.44 Favored 'Trans proline' 0 C--N 1.371 1.714 0 C-N-CA 122.382 2.055 . . . . 0.0 113.579 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 20.0 p90 -95.54 47.83 1.13 Allowed 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 121.732 0.777 . . . . 0.0 110.282 177.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.474 HG21 ' HG3' ' A' ' 95' ' ' ARG . 13.3 t -125.75 111.11 25.13 Favored Pre-proline 0 CA--C 1.559 1.302 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.241 178.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo -74.91 -13.48 21.63 Favored 'Trans proline' 0 C--N 1.369 1.651 0 C-N-CA 122.552 2.168 . . . . 0.0 111.834 169.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.415 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 10.8 m-85 -104.4 156.76 17.66 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.425 1.09 . . . . 0.0 110.331 -176.127 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 30.6 p -83.8 171.1 13.45 Favored 'General case' 0 N--CA 1.481 1.113 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 172.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -59.8 -35.55 74.91 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.46 0.704 . . . . 0.0 111.057 -176.017 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -58.03 -54.41 47.29 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 114.902 -1.045 . . . . 0.0 110.738 173.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.415 ' HB2' ' HB3' ' A' ' 104' ' ' PHE . 79.9 m -64.91 -35.8 82.3 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 123.885 0.741 . . . . 0.0 111.485 -178.544 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -63.72 -45.28 90.65 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.889 0.875 . . . . 0.0 110.258 -179.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.67 -20.39 61.25 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.344 177.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -98.37 8.8 44.36 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.006 0.922 . . . . 0.0 112.227 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 89.3 mt . . . . . 0 N--CA 1.482 1.164 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 173.49 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 8.0 mp . . . . . 0 N--CA 1.482 1.15 0 N-CA-C 110.232 -0.285 . . . . 0.0 110.232 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 68.43 17.52 9.13 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 125.145 1.378 . . . . 0.0 112.995 179.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 73.96 -84.61 0.69 Allowed Glycine 0 C--N 1.349 1.268 0 CA-C-O 119.821 -0.433 . . . . 0.0 113.358 178.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 74.67 -112.48 3.72 Favored Glycine 0 C--N 1.349 1.287 0 N-CA-C 112.241 -0.344 . . . . 0.0 112.241 -178.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -78.65 172.48 13.64 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 122.931 0.493 . . . . 0.0 109.858 171.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.9 t 64.84 29.89 12.39 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.249 1.02 . . . . 0.0 109.904 -175.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 55.2 ttp -64.34 119.14 9.76 Favored 'General case' 0 C--N 1.353 0.745 0 CA-C-N 115.074 -0.966 . . . . 0.0 108.725 172.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -76.1 72.28 2.9 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.219 0.608 . . . . 0.0 111.408 -173.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 59.3 t -62.85 -36.04 73.76 Favored 'Isoleucine or valine' 0 C--N 1.351 0.671 0 C-N-CA 123.629 0.772 . . . . 0.0 110.342 -178.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -60.77 -38.81 86.53 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.962 0.905 . . . . 0.0 111.948 -179.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 28.5 m -64.92 -44.34 89.83 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.505 0.722 . . . . 0.0 110.004 175.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.404 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 29.4 m-85 -69.47 -32.55 71.53 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.143 179.198 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -64.55 -54.92 24.54 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.438 1.095 . . . . 0.0 109.632 -176.167 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.01 -38.76 89.26 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.733 -176.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 12.6 tt -69.66 -31.36 48.43 Favored 'Isoleucine or valine' 0 C--N 1.362 1.113 0 N-CA-C 110.29 -0.263 . . . . 0.0 110.29 -179.176 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.555 ' HB3' HG23 ' A' ' 69' ' ' ILE . 55.3 mt -70.96 -38.51 72.79 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.273 0.629 . . . . 0.0 111.147 176.262 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.47 ' O ' ' HG3' ' A' ' 21' ' ' ARG . 1.3 mmp_? -59.63 -46.76 88.04 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 123.694 0.621 . . . . 0.0 110.049 176.009 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.494 ' HA ' ' HD2' ' A' ' 21' ' ' ARG . 3.8 m-20 -73.25 -32.9 64.98 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -69.04 -40.14 78.76 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 122.8 0.44 . . . . 0.0 110.639 179.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.642 ' HB3' HG21 ' A' ' 69' ' ' ILE . 3.5 pt20 -72.46 -31.38 65.38 Favored 'General case' 0 C--O 1.2 -1.54 0 CA-C-O 118.594 -0.717 . . . . 0.0 109.715 176.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.494 ' HD2' ' HA ' ' A' ' 18' ' ' ASP . 65.4 mtt-85 -58.49 -48.89 79.31 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-N 118.583 0.628 . . . . 0.0 111.276 178.551 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -70.58 -32.88 70.43 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.341 -178.031 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.478 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 96.6 mt -76.93 -34.02 57.68 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 122.724 0.41 . . . . 0.0 111.943 176.328 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -67.01 -51.13 58.74 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.954 0.901 . . . . 0.0 108.815 179.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.6 ptp180 -62.78 -32.13 73.24 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.538 0.735 . . . . 0.0 110.302 -179.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -60.79 -46.64 89.72 Favored 'General case' 0 C--N 1.363 1.174 0 C-N-CA 123.656 0.782 . . . . 0.0 111.782 176.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.567 ' HB2' ' HA ' ' A' ' 58' ' ' LEU . 2.7 pp -96.85 -0.37 47.95 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -177.741 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -116.31 25.93 10.29 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.895 0.878 . . . . 0.0 109.993 172.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.3 pttp -56.95 -30.8 64.38 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 124.699 1.2 . . . . 0.0 113.229 178.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.559 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -65.32 -37.94 81.35 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 124.304 1.042 . . . . 0.0 112.546 179.351 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -102.77 -15.67 16.2 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.747 0.819 . . . . 0.0 111.308 -174.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -121.91 96.62 5.13 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.154 0.982 . . . . 0.0 109.4 -178.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -90.0 86.33 6.57 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -137.17 98.76 3.81 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -66.48 -45.46 79.58 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 121.886 0.851 . . . . 0.0 110.045 178.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -127.99 91.78 43.87 Favored Pre-proline 0 CA--C 1.54 0.59 0 N-CA-C 106.989 -1.485 . . . . 0.0 106.989 174.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -65.81 80.72 0.26 Allowed 'Trans proline' 0 C--N 1.375 1.939 0 C-N-CA 123.246 2.63 . . . . 0.0 111.776 178.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 90.8 mtt180 -107.13 118.75 37.54 Favored 'General case' 0 C--O 1.239 0.536 0 C-N-CA 123.897 0.879 . . . . 0.0 109.107 -178.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 26.3 p-10 -160.86 154.65 18.84 Favored Pre-proline 0 CA--C 1.545 0.782 0 C-N-CA 124.308 1.043 . . . . 0.0 109.371 179.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -58.81 -46.94 20.37 Favored 'Trans proline' 0 C--N 1.376 2.004 0 C-N-CA 122.614 2.209 . . . . 0.0 111.65 173.045 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.5 t70 63.27 87.69 0.1 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.084 1.354 . . . . 0.0 111.563 175.195 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -139.77 85.76 2.06 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.839 0.855 . . . . 0.0 108.777 176.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -172.72 -102.45 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.538 1.135 . . . . 0.0 108.081 173.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 36.1 t70 167.12 149.25 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 126.179 1.792 . . . . 0.0 107.897 -178.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.431 ' HA ' ' HD2' ' A' ' 45' ' ' ARG . 12.7 tpt180 -132.55 66.26 1.56 Allowed 'General case' 0 C--O 1.244 0.79 0 CA-C-O 121.912 0.863 . . . . 0.0 110.313 176.156 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.63 102.44 7.99 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 163.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 38.0 m -66.64 142.35 57.49 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.236 0.614 . . . . 0.0 110.907 -174.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 18.6 mp0 -74.01 89.96 1.96 Allowed 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.991 0.916 . . . . 0.0 109.487 -174.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.1 mpt_? 66.41 118.39 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 125.035 1.334 . . . . 0.0 110.848 -175.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.0 m -67.74 131.54 45.75 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.706 0.802 . . . . 0.0 109.877 177.263 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -61.38 130.14 44.66 Favored 'General case' 0 C--N 1.352 0.701 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 168.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -80.72 50.78 1.39 Allowed 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.275 1.03 . . . . 0.0 112.493 -170.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 58.87 38.45 24.53 Favored 'General case' 0 C--N 1.358 0.943 0 C-N-CA 125.138 1.375 . . . . 0.0 111.002 175.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 62.9 t -66.49 -45.53 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 CA-C-N 114.77 -1.104 . . . . 0.0 110.424 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.43 ' HG ' ' H ' ' A' ' 57' ' ' GLU . 27.2 tp -86.71 138.15 31.87 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.375 -179.551 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -86.99 0.15 55.65 Favored 'General case' 0 CA--C 1.558 1.265 0 C-N-CA 123.798 0.839 . . . . 0.0 111.924 -174.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.43 ' H ' ' HG ' ' A' ' 55' ' ' LEU . 34.7 mm-40 -65.26 -18.87 65.66 Favored 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 123.257 0.623 . . . . 0.0 112.359 175.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.567 ' HA ' ' HB2' ' A' ' 27' ' ' LEU . 6.4 mp -78.27 108.58 11.71 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.243 173.173 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -76.99 143.47 28.8 Favored Glycine 0 N--CA 1.471 0.988 0 CA-C-O 118.502 -1.165 . . . . 0.0 110.992 179.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -51.81 -52.56 48.23 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 124.348 1.059 . . . . 0.0 112.546 -171.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.456 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 7.5 p -53.6 -39.12 36.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 O-C-N 123.841 0.713 . . . . 0.0 111.761 177.124 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.423 ' O ' HD13 ' A' ' 66' ' ' LEU . . . -68.59 -43.28 77.41 Favored Glycine 0 C--N 1.345 1.069 0 O-C-N 123.616 0.573 . . . . 0.0 112.152 177.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -67.26 -41.57 85.32 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.637 0.775 . . . . 0.0 110.997 -175.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -74.74 -28.23 60.69 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 124.094 0.871 . . . . 0.0 111.239 179.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.456 ' HB2' ' O ' ' A' ' 61' ' ' VAL . 0.5 OUTLIER -71.73 -44.86 63.4 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 177.63 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.423 HD13 ' O ' ' A' ' 62' ' ' GLY . 5.8 mp -57.0 -47.83 79.9 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.759 1.224 . . . . 0.0 110.171 170.416 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -61.47 -37.21 82.78 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.132 0.973 . . . . 0.0 110.834 -176.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.67 -40.97 65.88 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.064 0.946 . . . . 0.0 111.021 177.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.642 HG21 ' HB3' ' A' ' 20' ' ' GLN . 83.3 mt -66.29 -53.33 37.65 Favored 'Isoleucine or valine' 0 C--N 1.356 0.857 0 C-N-CA 123.493 0.717 . . . . 0.0 110.804 -179.205 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -65.35 -27.28 68.47 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.943 0.897 . . . . 0.0 111.925 178.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.3 -37.02 77.59 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 122.686 0.394 . . . . 0.0 110.326 172.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.518 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -69.62 -41.71 75.32 Favored 'General case' 0 C--N 1.348 0.507 0 C-N-CA 123.368 0.667 . . . . 0.0 110.644 176.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.532 HD23 HD12 ' A' ' 76' ' ' ILE . 86.5 mt -68.02 -32.55 73.0 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.181 0.993 . . . . 0.0 110.923 179.137 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.5 -38.93 85.07 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.819 0.848 . . . . 0.0 110.383 173.047 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.43 ' HE ' ' HA ' ' A' ' 72' ' ' ALA . 87.1 mtm180 -67.69 -30.53 70.07 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.979 174.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.532 HD12 HD23 ' A' ' 73' ' ' LEU . 74.2 mt -70.84 -40.85 77.1 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 175.571 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.5 -32.46 72.49 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.896 0.878 . . . . 0.0 111.526 177.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.491 ' HB3' HG22 ' A' ' 80' ' ' THR . 34.2 t -88.08 -22.54 24.11 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.465 0.706 . . . . 0.0 111.154 176.453 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 85.31 9.77 78.9 Favored Glycine 0 C--N 1.346 1.116 0 CA-C-N 116.594 -0.275 . . . . 0.0 113.058 -175.552 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.491 HG22 ' HB3' ' A' ' 78' ' ' SER . 15.0 t -102.97 26.4 8.21 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.221 1.008 . . . . 0.0 109.612 179.302 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 90.9 t80 -63.93 147.74 51.23 Favored 'General case' 0 C--N 1.351 0.642 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 171.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 69.56 46.39 55.33 Favored Glycine 0 C--N 1.341 0.854 0 N-CA-C 110.737 -0.945 . . . . 0.0 110.737 -172.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 98.7 m -129.63 116.95 19.61 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.703 0.801 . . . . 0.0 110.167 174.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 42.9 t -68.52 100.26 1.08 Allowed 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 166.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 33.7 m -62.19 -27.4 42.48 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 123.995 0.918 . . . . 0.0 112.456 -176.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.488 ' HD2' ' HB3' ' A' ' 108' ' ' CYS . 24.5 ttmm -67.21 -33.69 75.9 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.496 0.718 . . . . 0.0 110.24 174.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 54.7 m -86.89 -29.18 22.34 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.632 0.773 . . . . 0.0 111.149 174.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 66.99 22.09 72.05 Favored Glycine 0 C--N 1.342 0.894 0 CA-C-N 115.79 -0.641 . . . . 0.0 112.392 -165.2 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -138.1 173.44 11.62 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.764 0.826 . . . . 0.0 110.684 -173.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 -64.89 151.47 45.54 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.943 1.297 . . . . 0.0 114.335 -170.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 13.7 mm -90.94 150.78 3.64 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.952 0 C-N-CA 125.537 1.535 . . . . 0.0 109.131 173.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 31.6 m -75.97 151.95 37.13 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 175.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -59.16 -41.62 88.79 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.202 0.601 . . . . 0.0 111.142 -179.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -61.7 -39.46 91.55 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.042 0.937 . . . . 0.0 111.217 -178.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.535 ' HE ' HG21 ' A' ' 102' ' ' THR . 29.7 tpt180 -64.74 -42.98 94.79 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.741 176.293 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 92.1 mt -67.98 -41.6 82.1 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.362 0.665 . . . . 0.0 112.209 -176.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -71.8 -28.3 63.51 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 122.587 0.355 . . . . 0.0 110.55 -178.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.22 -38.3 27.21 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.54 0.736 . . . . 0.0 110.884 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.4 p -160.76 95.55 1.45 Allowed Pre-proline 0 CA--C 1.559 1.291 0 C-N-CA 124.738 1.215 . . . . 0.0 109.501 -176.108 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . 0.511 ' HG2' HD21 ' A' ' 16' ' ' LEU . 69.2 Cg_endo -77.56 -23.28 9.97 Favored 'Trans proline' 0 C--N 1.375 1.972 0 C-N-CA 122.618 2.212 . . . . 0.0 113.539 -178.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 32.1 p90 -80.93 -9.3 59.85 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 -174.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.535 HG21 ' HE ' ' A' ' 95' ' ' ARG . 12.4 t -64.87 125.99 90.14 Favored Pre-proline 0 CA--C 1.565 1.527 0 CA-C-N 117.731 0.242 . . . . 0.0 111.187 -176.199 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -75.83 -12.93 19.89 Favored 'Trans proline' 0 C--N 1.375 1.931 0 C-N-CA 122.62 2.213 . . . . 0.0 112.627 174.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -121.68 157.11 31.6 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.608 0.763 . . . . 0.0 110.161 -176.268 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.48 ' SG ' ' OE1' ' A' ' 107' ' ' GLU . 29.3 p -86.02 165.21 16.86 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 175.607 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -46.39 -44.16 16.89 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 124.886 1.274 . . . . 0.0 114.35 -160.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.48 ' OE1' ' SG ' ' A' ' 105' ' ' CYS . 0.0 OUTLIER -84.04 -26.86 28.76 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 122.215 -0.303 . . . . 0.0 110.787 -176.286 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.488 ' HB3' ' HD2' ' A' ' 86' ' ' LYS . 95.7 m -69.86 -26.45 64.21 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.961 0.904 . . . . 0.0 110.473 174.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -75.45 -36.23 60.74 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.851 0.86 . . . . 0.0 110.048 172.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -78.13 -8.86 58.8 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.942 173.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -86.11 -9.47 56.61 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.647 0.779 . . . . 0.0 111.117 174.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 55.1 mt . . . . . 0 CA--C 1.554 1.104 0 C-N-CA 123.127 0.571 . . . . 0.0 109.542 176.086 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.6 tt . . . . . 0 N--CA 1.482 1.126 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 66.7 165.52 0.21 Allowed 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 125.051 1.34 . . . . 0.0 112.397 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 178.3 56.39 0.07 OUTLIER Glycine 0 C--N 1.341 0.85 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.796 -178.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -80.66 72.85 2.62 Favored Glycine 0 C--N 1.342 0.893 0 CA-C-N 115.305 -0.447 . . . . 0.0 112.777 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -78.11 137.74 38.36 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.355 0.662 . . . . 0.0 109.948 176.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 19.8 m -61.77 -36.09 80.02 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.764 0.826 . . . . 0.0 112.334 -172.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 26.8 ptm -76.32 -22.14 55.33 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-O 119.108 -0.473 . . . . 0.0 111.213 179.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 11.5 m120 73.75 44.18 0.3 Allowed 'General case' 0 N--CA 1.494 1.754 0 C-N-CA 125.442 1.497 . . . . 0.0 112.47 176.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.5 t -50.98 -46.83 30.64 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 C-N-CA 123.571 0.748 . . . . 0.0 112.088 175.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -65.56 -36.01 82.53 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.515 0.726 . . . . 0.0 111.681 -176.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.0 m -67.11 -37.97 84.82 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.256 176.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -70.23 -35.5 73.88 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.272 176.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.1 tm-20 -60.71 -57.63 11.87 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.984 0.913 . . . . 0.0 109.381 -176.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.436 ' HG3' ' N ' ' A' ' 15' ' ' ILE . 12.8 ptmt -63.82 -42.11 97.73 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.592 -176.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.436 ' N ' ' HG3' ' A' ' 14' ' ' LYS . 15.2 tt -68.78 -29.48 43.72 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 -175.061 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.524 ' HB3' HG23 ' A' ' 69' ' ' ILE . 70.7 mt -74.01 -35.48 64.39 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.241 0.616 . . . . 0.0 110.779 174.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.445 ' NH2' HD13 ' A' ' 73' ' ' LEU . 1.7 mmp_? -59.98 -49.28 78.29 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 172.356 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 49.2 m-20 -64.12 -41.64 97.15 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 124.006 0.922 . . . . 0.0 110.943 -177.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -66.87 -46.02 76.29 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.68 -178.626 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.592 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.8 pt20 -67.45 -29.25 68.67 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-O 118.871 -0.585 . . . . 0.0 110.099 -179.394 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.402 ' HG2' ' O ' ' A' ' 17' ' ' ARG . 33.3 mmt180 -70.22 -46.86 63.64 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.708 0.803 . . . . 0.0 111.867 -179.301 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -68.43 -32.7 72.92 Favored 'General case' 0 N--CA 1.48 1.067 0 O-C-N 123.238 0.336 . . . . 0.0 110.542 178.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 97.1 mt -74.54 -33.29 62.7 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.021 174.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -58.89 -59.66 5.09 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 38.3 ptt180 -59.01 -37.57 77.21 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 123.719 0.637 . . . . 0.0 111.28 -178.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 75.5 ttt180 -57.42 -56.11 26.15 Favored 'General case' 0 C--N 1.356 0.874 0 C-N-CA 124.119 0.968 . . . . 0.0 112.046 178.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.426 ' O ' ' HA ' ' A' ' 58' ' ' LEU . 4.5 pp -87.85 -22.55 24.39 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -172.536 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -90.39 23.46 2.94 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 175.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.4 ptpp? -44.17 -34.3 1.8 Allowed 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 126.582 1.953 . . . . 0.0 113.831 179.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.476 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -60.76 -32.19 51.33 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.123 0 C-N-CA 124.22 1.008 . . . . 0.0 111.775 -179.811 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.436 ' HG2' HG12 ' A' ' 30' ' ' ILE . 19.2 mm-40 -97.75 -53.08 3.53 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.585 1.154 . . . . 0.0 109.553 175.453 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -78.17 95.48 4.95 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-N 114.173 -1.376 . . . . 0.0 110.561 -173.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -74.82 125.57 29.07 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 114.801 -1.091 . . . . 0.0 109.266 175.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 -82.7 54.8 2.78 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.893 0.877 . . . . 0.0 111.313 -177.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -76.71 -44.95 31.39 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.388 0.675 . . . . 0.0 109.333 173.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -106.74 129.59 24.18 Favored Pre-proline 0 CA--C 1.552 1.04 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.395 -178.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_exo -74.41 92.71 0.92 Allowed 'Trans proline' 0 C--N 1.377 2.059 0 C-N-CA 122.874 2.383 . . . . 0.0 109.517 167.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 16.2 mtp180 -70.82 143.95 50.95 Favored 'General case' 0 N--CA 1.478 0.962 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.586 -174.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -65.01 145.46 99.1 Favored Pre-proline 0 N--CA 1.478 0.949 0 C-N-CA 123.64 0.776 . . . . 0.0 110.744 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -76.95 69.17 7.08 Favored 'Trans proline' 0 C--N 1.384 2.412 0 C-N-CA 122.867 2.378 . . . . 0.0 110.518 176.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.7 t70 172.43 -43.97 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 126.059 1.744 . . . . 0.0 107.591 -171.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 25.5 t70 60.07 -126.89 1.1 Allowed 'General case' 0 CA--C 1.562 1.425 0 CA-C-N 113.888 -1.506 . . . . 0.0 109.438 -179.022 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -165.41 19.21 0.05 OUTLIER 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.939 0.895 . . . . 0.0 110.613 179.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -109.3 100.17 9.32 Favored 'General case' 0 C--O 1.24 0.577 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -74.14 -29.34 61.76 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.163 178.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.5 78.39 1.44 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.586 0.754 . . . . 0.0 110.48 -179.05 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.5 m -94.24 82.09 4.09 Favored 'General case' 0 C--O 1.241 0.643 0 C-N-CA 123.743 0.817 . . . . 0.0 109.256 -177.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -68.0 121.3 15.8 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.859 -178.531 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 29.1 ptt180 -84.41 92.42 8.05 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.057 0.943 . . . . 0.0 110.06 178.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 36.0 p -155.62 80.21 1.02 Allowed 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.352 0.596 . . . . 0.0 109.99 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 63.0 t30 -95.28 78.41 3.46 Favored 'General case' 0 C--O 1.244 0.766 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 178.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -89.53 79.6 6.86 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -68.75 102.78 1.6 Allowed 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 113.63 -1.623 . . . . 0.0 111.287 -176.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 47.7 t -124.14 -43.75 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 176.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 30.0 tp -83.55 125.5 31.84 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.181 175.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -93.5 12.82 23.77 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 123.545 0.738 . . . . 0.0 111.144 -175.361 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -83.32 13.68 4.14 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.323 0.649 . . . . 0.0 111.351 174.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.426 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 68.5 mt -79.62 -70.28 0.52 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 122.94 0.496 . . . . 0.0 110.413 178.01 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 127.0 114.51 1.88 Allowed Glycine 0 N--CA 1.472 1.035 0 N-CA-C 110.819 -0.913 . . . . 0.0 110.819 -176.392 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -49.93 -52.62 31.93 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.273 1.429 . . . . 0.0 113.37 -170.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 7.4 p -53.08 -42.56 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 123.234 0.614 . . . . 0.0 112.205 -178.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -74.74 -32.83 56.73 Favored Glycine 0 C--N 1.344 1.011 0 CA-C-N 115.538 -0.756 . . . . 0.0 112.113 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -68.34 -45.76 71.99 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.626 0.77 . . . . 0.0 111.43 -179.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -64.76 -36.75 85.32 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.542 0.737 . . . . 0.0 109.662 176.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.31 -48.56 75.18 Favored 'General case' 0 C--N 1.354 0.789 0 O-C-N 124.122 0.889 . . . . 0.0 110.467 177.416 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.4 mp -57.38 -46.62 83.2 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.175 0.99 . . . . 0.0 110.635 177.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 77.2 ttt180 -62.24 -37.1 84.11 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.508 -178.1 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.454 ' HB1' ' O ' ' A' ' 101' ' ' TYR . . . -74.53 -39.33 62.43 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 123.995 0.918 . . . . 0.0 111.542 179.201 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.592 HG21 ' HB3' ' A' ' 20' ' ' GLN . 85.3 mt -73.06 -54.92 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 123.785 0.834 . . . . 0.0 110.39 -176.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -59.67 -30.18 68.58 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.05 0.94 . . . . 0.0 111.789 176.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.476 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -64.11 -52.68 57.99 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 123.429 0.456 . . . . 0.0 110.319 172.094 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.466 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -61.2 -40.41 93.84 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.929 0.892 . . . . 0.0 111.496 -178.138 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.519 HD23 HD12 ' A' ' 76' ' ' ILE . 66.1 mt -67.84 -37.1 81.46 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.711 1.205 . . . . 0.0 111.505 178.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.61 -33.04 75.01 Favored 'General case' 0 N--CA 1.478 0.951 0 O-C-N 123.615 0.572 . . . . 0.0 110.296 173.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.476 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 79.7 mtt-85 -79.99 -25.91 40.12 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.274 0.629 . . . . 0.0 111.466 178.288 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.519 HD12 HD23 ' A' ' 73' ' ' LEU . 98.1 mt -71.33 -49.9 44.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 175.708 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.19 -28.09 68.49 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.606 0.762 . . . . 0.0 111.106 178.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 30.5 t -75.56 -34.22 60.7 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.43 0.692 . . . . 0.0 110.627 172.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 90.78 7.94 65.88 Favored Glycine 0 CA--C 1.53 0.989 0 CA-C-N 115.759 -0.655 . . . . 0.0 113.158 -176.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 14.0 t -97.44 10.35 39.95 Favored 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 123.669 0.788 . . . . 0.0 110.481 178.019 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -64.93 136.55 56.95 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.082 0.553 . . . . 0.0 109.914 171.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.15 13.14 64.51 Favored Glycine 0 CA--C 1.527 0.803 0 O-C-N 123.619 0.575 . . . . 0.0 111.89 -169.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 89.4 m -125.68 119.67 28.63 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 123.741 0.816 . . . . 0.0 109.753 175.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.469 ' HB2' HD13 ' A' ' 91' ' ' ILE . 49.6 t -77.06 91.89 3.7 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 124.072 0.949 . . . . 0.0 109.743 170.635 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 25.3 m -64.35 -20.02 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 124.016 0.927 . . . . 0.0 112.152 -178.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 49.8 tttm -66.41 -22.8 66.24 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.928 0.891 . . . . 0.0 111.874 -179.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.428 ' SG ' ' HB2' ' A' ' 89' ' ' LYS . 31.7 p -137.85 10.07 2.85 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 122.635 0.374 . . . . 0.0 111.488 177.014 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 63.85 20.21 64.07 Favored Glycine 0 C--N 1.358 1.76 0 N-CA-C 114.185 0.434 . . . . 0.0 114.185 179.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.428 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 31.6 mmmt -106.92 -173.77 2.37 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.094 0.958 . . . . 0.0 110.62 -176.487 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 13.1 mmm180 -83.54 163.84 20.18 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 124.454 1.102 . . . . 0.0 112.139 176.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.469 HD13 ' HB2' ' A' ' 84' ' ' CYS . 5.7 mm -101.21 143.43 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 N-CA-C 106.416 -1.698 . . . . 0.0 106.416 159.361 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.6 m -70.9 140.82 51.13 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 173.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -61.06 -35.86 78.08 Favored 'General case' 0 N--CA 1.483 1.185 0 CA-C-N 117.95 0.341 . . . . 0.0 110.124 174.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -58.29 -40.92 83.23 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.187 0.995 . . . . 0.0 110.34 175.337 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.531 ' HD2' ' HB2' ' A' ' 106' ' ' GLN . 0.2 OUTLIER -68.71 -40.19 80.08 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.699 176.947 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 94.6 mt -69.01 -34.81 75.87 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.844 0.858 . . . . 0.0 112.307 -176.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 15.5 ptpt -80.73 -27.08 36.99 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 122.627 0.371 . . . . 0.0 110.215 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -79.31 -29.36 42.34 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.643 0.777 . . . . 0.0 110.999 175.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.422 ' O ' HG22 ' A' ' 102' ' ' THR . 2.3 p -165.84 99.9 0.74 Allowed Pre-proline 0 CA--C 1.557 1.244 0 C-N-CA 124.828 1.251 . . . . 0.0 108.909 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . 0.423 ' HG2' HD21 ' A' ' 16' ' ' LEU . 79.2 Cg_endo -78.21 -12.93 15.65 Favored 'Trans proline' 0 C--N 1.373 1.845 0 C-N-CA 122.65 2.233 . . . . 0.0 113.681 179.113 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . 0.454 ' O ' ' HB1' ' A' ' 68' ' ' ALA . 24.0 p90 -94.66 22.02 6.73 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 122.601 0.361 . . . . 0.0 111.932 -179.211 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.422 HG22 ' O ' ' A' ' 99' ' ' VAL . 14.1 t -97.51 112.48 61.35 Favored Pre-proline 0 CA--C 1.56 1.358 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 172.526 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -78.39 -4.44 14.22 Favored 'Trans proline' 0 C--N 1.376 1.977 0 C-N-CA 122.635 2.224 . . . . 0.0 112.009 171.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -114.75 146.15 41.29 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.957 0.903 . . . . 0.0 109.975 -176.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 26.0 p -75.67 160.72 29.77 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 175.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.531 ' HB2' ' HD2' ' A' ' 95' ' ' ARG . 52.0 tp60 -56.61 -29.95 62.73 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 118.387 0.539 . . . . 0.0 111.779 -175.312 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -61.57 -49.75 75.41 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 124.826 1.25 . . . . 0.0 109.844 177.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 98.3 m -70.3 -36.29 74.25 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.346 0.658 . . . . 0.0 111.662 177.047 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -61.38 -33.97 74.55 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.782 0.833 . . . . 0.0 110.968 179.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -82.6 -28.91 30.52 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.819 0.847 . . . . 0.0 111.152 175.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -105.47 24.46 12.12 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 124.065 0.946 . . . . 0.0 112.61 -174.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 86.3 mt . . . . . 0 N--CA 1.487 1.412 0 C-N-CA 123.464 0.706 . . . . 0.0 111.193 177.976 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 7.8 mp . . . . . 0 N--CA 1.476 0.853 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -162.05 16.15 0.09 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.541 1.136 . . . . 0.0 109.808 174.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -69.79 138.21 29.69 Favored Glycine 0 C--N 1.356 1.661 0 CA-C-N 115.952 -0.567 . . . . 0.0 113.32 -174.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 86.37 140.66 5.97 Favored Glycine 0 C--N 1.348 1.235 0 N-CA-C 111.977 -0.449 . . . . 0.0 111.977 -177.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -102.29 17.28 23.84 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.966 0.906 . . . . 0.0 111.143 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 32.8 m -61.91 -44.52 96.62 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.78 0.832 . . . . 0.0 111.842 -175.043 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 45.5 ttm -71.81 -38.06 70.27 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.047 177.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 52.5 t30 57.27 100.1 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 125.6 1.56 . . . . 0.0 112.026 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.8 t -71.57 -26.43 26.24 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.034 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.199 -179.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -58.53 -42.21 87.26 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 123.207 0.603 . . . . 0.0 112.544 -174.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 33.2 m -59.73 -41.86 91.83 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 121.352 0.596 . . . . 0.0 110.833 178.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -71.34 -38.39 71.66 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-N 114.942 -1.026 . . . . 0.0 110.487 179.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.469 ' O ' ' HG3' ' A' ' 17' ' ' ARG . 3.0 tm-20 -57.9 -54.95 41.09 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.507 1.123 . . . . 0.0 110.127 -177.546 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.56 -41.59 88.4 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.171 -176.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 14.9 tt -68.22 -29.94 46.14 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 N-CA-C 110.329 -0.249 . . . . 0.0 110.329 -177.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.541 ' HB3' HG23 ' A' ' 69' ' ' ILE . 77.5 mt -73.35 -33.19 64.96 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.673 0.789 . . . . 0.0 111.168 176.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.469 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 25.7 mtm180 -64.51 -37.51 87.78 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 175.274 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -82.52 -24.68 33.98 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.002 0.521 . . . . 0.0 110.522 -178.536 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.428 ' HD2' ' HA ' ' A' ' 19' ' ' ARG . 18.4 tpt180 -73.45 -43.45 60.29 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.505 179.347 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.576 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.7 pt20 -73.45 -29.46 62.56 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 119.005 -0.521 . . . . 0.0 110.018 176.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 91.8 mtt180 -55.29 -58.29 8.32 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 172.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.4 ' HA ' ' HE ' ' A' ' 25' ' ' ARG . 11.7 pt-20 -63.78 -38.24 90.37 Favored 'General case' 0 C--N 1.352 0.686 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.098 -175.166 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.712 HD23 HH11 ' A' ' 26' ' ' ARG . 89.4 mt -65.34 -52.24 55.12 Favored 'General case' 0 C--O 1.216 -0.688 0 O-C-N 123.877 0.735 . . . . 0.0 110.956 177.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -48.0 -53.49 16.03 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 124.303 1.041 . . . . 0.0 111.25 -178.575 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.4 ' HE ' ' HA ' ' A' ' 22' ' ' GLU . 29.8 ptt180 -74.88 -26.19 59.49 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -178.713 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.712 HH11 HD23 ' A' ' 23' ' ' LEU . 39.5 ttm180 -66.58 -48.94 67.97 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.832 0.853 . . . . 0.0 111.124 175.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.553 HD21 HD22 ' A' ' 66' ' ' LEU . 4.1 pp -80.38 -24.69 39.59 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.31 0.644 . . . . 0.0 110.679 -178.192 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 52.6 m170 -80.92 21.04 0.72 Allowed 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.171 0.589 . . . . 0.0 111.21 171.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.1 pttp -49.12 -29.28 5.09 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 124.811 1.245 . . . . 0.0 113.124 175.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.47 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -68.27 -30.26 47.16 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.161 0 C-N-CA 123.88 0.872 . . . . 0.0 112.316 179.491 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -121.95 -5.85 9.02 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 124.176 0.99 . . . . 0.0 111.462 -173.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -109.38 105.42 14.79 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.007 0.923 . . . . 0.0 108.695 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -83.19 78.1 9.66 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 123.54 0.736 . . . . 0.0 109.101 -176.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 61.1 t80 56.17 80.78 0.14 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.55 1.14 . . . . 0.0 111.185 -173.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -88.82 -18.52 27.49 Favored 'General case' 0 CA--C 1.551 1.002 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 173.506 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 68.97 118.86 0.03 OUTLIER Pre-proline 0 C--N 1.362 1.123 0 C-N-CA 126.001 1.72 . . . . 0.0 110.757 -177.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -50.56 -40.04 55.14 Favored 'Trans proline' 0 C--N 1.386 2.552 0 C-N-CA 123.68 2.92 . . . . 0.0 113.388 -176.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 25.4 ptt180 -141.87 92.5 2.45 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-O 122.105 0.955 . . . . 0.0 110.693 -177.071 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 21.0 p-10 -75.2 124.53 89.32 Favored Pre-proline 0 CA--C 1.542 0.658 0 CA-C-N 114.903 -1.044 . . . . 0.0 108.638 169.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -65.7 -27.71 52.42 Favored 'Trans proline' 0 C--N 1.371 1.735 0 C-N-CA 122.58 2.186 . . . . 0.0 112.305 -177.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -106.75 97.38 7.17 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 108.177 -1.045 . . . . 0.0 108.177 176.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -74.83 110.68 9.32 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 121.342 0.592 . . . . 0.0 110.611 -179.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -81.08 -39.32 25.89 Favored 'General case' 0 C--O 1.242 0.66 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 168.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.8 t70 73.27 143.39 0.07 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.833 1.653 . . . . 0.0 113.251 171.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 30.3 mmt180 -128.42 98.48 5.06 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 113.91 -1.496 . . . . 0.0 107.543 168.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -79.56 54.3 1.74 Allowed 'General case' 0 CA--C 1.549 0.933 0 CA-C-O 122.057 0.932 . . . . 0.0 108.963 168.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 35.3 t -91.52 175.24 6.98 Favored 'General case' 0 C--O 1.241 0.617 0 C-N-CA 124.73 1.212 . . . . 0.0 109.883 -172.563 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -74.93 161.21 29.71 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-O 121.479 0.657 . . . . 0.0 111.471 176.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 74.6 mtm180 -83.28 -63.79 1.29 Allowed 'General case' 0 C--O 1.239 0.531 0 CA-C-N 114.457 -1.247 . . . . 0.0 109.418 -174.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 25.0 t 62.91 164.42 0.11 Allowed 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 124.727 1.211 . . . . 0.0 112.288 176.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 63.0 t30 64.96 100.03 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.062 0.945 . . . . 0.0 111.185 178.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -81.89 -2.61 51.82 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.059 0.544 . . . . 0.0 112.26 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 44.9 mm-40 -62.9 133.69 55.07 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.347 0.659 . . . . 0.0 111.143 178.049 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 43.8 t -69.19 -48.38 69.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 176.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 34.4 tp 59.57 107.2 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.896 0 O-C-N 125.168 1.543 . . . . 0.0 112.129 174.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -69.86 -10.14 57.38 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.492 0.717 . . . . 0.0 111.843 -178.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -81.63 -6.49 59.05 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.378 0.671 . . . . 0.0 111.593 176.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.478 HD13 HD13 ' A' ' 27' ' ' LEU . 31.8 mt -83.43 136.86 34.15 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 167.714 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -58.68 130.12 50.58 Favored Glycine 0 CA--C 1.534 1.242 0 CA-C-O 119.207 -0.774 . . . . 0.0 112.197 176.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -67.15 -42.21 84.75 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.304 0.642 . . . . 0.0 112.313 -171.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 7.3 p -59.9 -32.09 49.07 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 C-N-CA 122.926 0.491 . . . . 0.0 109.74 173.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.529 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -64.86 -56.69 15.01 Favored Glycine 0 C--O 1.214 -1.104 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.615 174.586 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.445 ' NE2' ' HB2' ' A' ' 58' ' ' LEU . 98.0 mt-30 -58.9 -43.77 91.07 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 125.173 1.389 . . . . 0.0 111.946 -176.631 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -67.28 -49.11 65.57 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.125 -175.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -70.02 -28.9 65.87 Favored 'General case' 0 C--O 1.217 -0.614 0 CA-C-N 114.649 -1.16 . . . . 0.0 110.24 179.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.553 HD22 HD21 ' A' ' 27' ' ' LEU . 11.1 tp -64.24 -44.79 90.74 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.358 1.063 . . . . 0.0 109.551 178.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 65.2 ttt180 -74.95 -29.48 60.94 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 114.736 -1.12 . . . . 0.0 110.507 -179.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.57 -41.34 88.72 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.423 0.689 . . . . 0.0 110.247 174.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.576 HG21 ' HB3' ' A' ' 20' ' ' GLN . 95.5 mt -70.56 -37.76 71.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.887 0.875 . . . . 0.0 109.875 175.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -63.24 -36.43 83.62 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.272 0.629 . . . . 0.0 110.268 176.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -75.88 -34.08 59.98 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.906 0.882 . . . . 0.0 111.113 177.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.473 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -69.92 -53.88 15.88 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.441 0.696 . . . . 0.0 110.73 -179.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.583 HD23 HD12 ' A' ' 76' ' ' ILE . 95.5 mt -61.78 -31.94 72.19 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.455 1.102 . . . . 0.0 111.249 176.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.53 -49.69 76.54 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 123.615 0.572 . . . . 0.0 110.175 172.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.464 ' HE ' ' HA ' ' A' ' 72' ' ' ALA . 86.8 mtm180 -63.56 -30.9 71.95 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 124.043 0.839 . . . . 0.0 111.844 178.427 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.583 HD12 HD23 ' A' ' 73' ' ' LEU . 66.4 mt -69.24 -43.42 81.37 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 177.019 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.62 -25.23 64.74 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.941 176.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 69.8 m -91.61 -7.55 49.78 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.413 1.085 . . . . 0.0 112.344 178.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 69.33 23.46 76.36 Favored Glycine 0 C--N 1.35 1.325 0 N-CA-C 113.77 0.268 . . . . 0.0 113.77 178.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 9.9 t -129.85 29.34 5.0 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 124.589 1.156 . . . . 0.0 110.449 -179.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -63.97 148.66 49.07 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 121.938 -0.476 . . . . 0.0 110.271 171.573 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.462 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 70.09 37.72 73.07 Favored Glycine 0 C--N 1.342 0.866 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.611 -175.267 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 90.8 m -129.45 124.06 33.13 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.588 0.755 . . . . 0.0 109.448 175.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.421 ' HB3' ' HB2' ' A' ' 87' ' ' CYS . 37.5 t -67.85 108.37 2.97 Favored 'General case' 0 C--N 1.35 0.622 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 169.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 29.2 m -62.34 -28.47 44.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 O-C-N 124.134 0.896 . . . . 0.0 111.167 176.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 38.3 tttm -81.11 -8.04 59.68 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.518 1.127 . . . . 0.0 111.673 -177.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.529 ' HB3' ' HG2' ' A' ' 89' ' ' LYS . 60.8 m -122.07 -24.1 5.22 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.895 0.878 . . . . 0.0 111.696 176.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 62.77 46.58 93.35 Favored Glycine 0 CA--C 1.537 1.425 0 O-C-N 123.508 0.505 . . . . 0.0 113.178 -168.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.529 ' HG2' ' HB3' ' A' ' 87' ' ' CYS . 0.0 OUTLIER -159.88 171.17 19.91 Favored 'General case' 0 N--CA 1.498 1.945 0 N-CA-C 112.616 0.598 . . . . 0.0 112.616 -179.103 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.462 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 13.9 tpp180 -64.4 144.11 57.41 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 125.377 1.471 . . . . 0.0 113.192 -172.462 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 26.1 mm -91.73 149.7 4.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 125.179 1.392 . . . . 0.0 108.847 172.069 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 24.8 m -67.58 140.59 56.94 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 174.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -59.21 -36.54 75.59 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 122.869 0.468 . . . . 0.0 111.209 -178.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -63.96 -36.05 82.68 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.658 0.783 . . . . 0.0 111.267 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.523 ' HD2' ' HB2' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -65.57 -40.71 93.09 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.221 175.45 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 95.2 mt -75.07 -31.74 61.31 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -176.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.2 ptpt -76.03 -28.17 57.61 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 109.827 -0.435 . . . . 0.0 109.827 178.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -83.48 -35.24 25.05 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.671 0.788 . . . . 0.0 111.316 176.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.4 p -158.53 91.9 2.06 Favored Pre-proline 0 CA--C 1.557 1.237 0 C-N-CA 124.536 1.134 . . . . 0.0 109.055 -177.162 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . 0.527 ' HG2' HD21 ' A' ' 16' ' ' LEU . 58.8 Cg_endo -74.06 -28.27 11.12 Favored 'Trans proline' 0 C--N 1.377 2.069 0 C-N-CA 122.639 2.226 . . . . 0.0 113.324 -178.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . 0.458 ' HA ' ' HB2' ' A' ' 72' ' ' ALA . 29.6 p90 -77.96 -2.55 37.51 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -173.407 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.1 t -65.62 116.77 34.82 Favored Pre-proline 0 CA--C 1.563 1.457 0 CA-C-N 117.862 0.301 . . . . 0.0 110.72 -179.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -73.45 -16.51 24.38 Favored 'Trans proline' 0 C--N 1.381 2.259 0 C-N-CA 122.489 2.126 . . . . 0.0 111.474 175.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.489 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 12.7 m-85 -113.11 174.83 5.71 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.421 1.088 . . . . 0.0 110.279 -176.262 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 31.1 p -98.19 173.97 6.75 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.193 0.597 . . . . 0.0 109.812 175.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.523 ' HB2' ' HD2' ' A' ' 95' ' ' ARG . 6.6 tp60 -56.66 -38.94 72.89 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.443 0.697 . . . . 0.0 112.325 -177.042 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -64.24 -48.51 75.52 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.169 0.588 . . . . 0.0 111.404 179.186 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.489 ' HB2' ' HB3' ' A' ' 104' ' ' PHE . 97.0 m -64.85 -36.17 83.47 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.044 0.538 . . . . 0.0 110.91 176.442 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.58 -35.25 78.65 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.824 0.849 . . . . 0.0 110.68 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -77.09 -25.37 52.21 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.784 175.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -90.62 -5.4 55.91 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.743 0.817 . . . . 0.0 112.098 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 108' ' ' CYS . 70.8 mt . . . . . 0 N--CA 1.48 1.066 0 C-N-CA 122.943 0.497 . . . . 0.0 109.665 173.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.432 ' HB2' HG21 ' A' ' 83' ' ' THR . 2.4 pt? . . . . . 0 N--CA 1.484 1.23 0 CA-C-O 120.639 0.257 . . . . 0.0 111.202 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -69.2 147.45 51.27 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.842 0.857 . . . . 0.0 111.876 -179.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -154.12 -29.0 0.03 OUTLIER Glycine 0 C--N 1.339 0.721 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.939 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 81.53 -124.09 6.31 Favored Glycine 0 C--N 1.346 1.107 0 CA-C-N 115.506 -0.347 . . . . 0.0 112.775 175.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.543 ' HA ' ' HB ' ' A' ' 9' ' ' VAL . 33.3 mmtp -109.61 0.04 18.9 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.923 0.889 . . . . 0.0 111.783 179.447 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.0 m -69.23 151.26 46.51 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.366 0.666 . . . . 0.0 110.17 173.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 33.9 ttp 70.0 44.66 0.78 Allowed 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 122.231 1.015 . . . . 0.0 109.63 -173.246 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 58.87 31.92 21.74 Favored 'General case' 0 N--CA 1.485 1.322 0 CA-C-N 114.653 -1.158 . . . . 0.0 113.107 166.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.543 ' HB ' ' HA ' ' A' ' 5' ' ' LYS . 88.6 t -60.93 -28.6 43.81 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 CA-C-O 119.064 -0.493 . . . . 0.0 111.826 -176.222 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -59.5 -49.17 78.81 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 174.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.9 m -58.43 -42.45 87.31 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.891 0.876 . . . . 0.0 110.755 179.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -73.16 -32.45 64.87 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.112 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 9' ' ' VAL . 3.3 tm-20 -63.99 -54.19 38.26 Favored 'General case' 0 C--O 1.243 0.728 0 C-N-CA 124.535 1.134 . . . . 0.0 109.984 -177.019 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.6 -45.0 80.61 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 114.396 -1.275 . . . . 0.0 111.406 -177.254 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 10.8 tt -64.77 -33.4 63.14 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 CA-C-N 118.08 0.4 . . . . 0.0 110.713 -175.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.575 ' HB3' HG23 ' A' ' 69' ' ' ILE . 37.5 mt -65.77 -45.29 83.07 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.348 0.659 . . . . 0.0 111.127 175.497 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.508 ' O ' ' HG3' ' A' ' 21' ' ' ARG . 52.1 mtm180 -62.81 -46.47 87.81 Favored 'General case' 0 C--O 1.214 -0.783 0 O-C-N 123.647 0.592 . . . . 0.0 110.986 177.691 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -56.75 -46.97 81.08 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.686 0.795 . . . . 0.0 111.268 176.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? -66.24 -33.11 75.01 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.269 179.186 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.668 ' HB3' HG21 ' A' ' 69' ' ' ILE . 1.3 pt20 -81.78 -22.14 37.35 Favored 'General case' 0 C--O 1.21 -0.985 0 CA-C-O 118.805 -0.617 . . . . 0.0 110.486 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.508 ' HG3' ' O ' ' A' ' 17' ' ' ARG . 82.4 mtt180 -65.08 -49.21 70.91 Favored 'General case' 0 N--CA 1.484 1.273 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 175.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -65.76 -37.54 86.62 Favored 'General case' 0 C--N 1.355 0.84 0 O-C-N 123.962 0.789 . . . . 0.0 110.676 179.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 71.9 mt -69.21 -41.03 77.62 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 122.803 0.441 . . . . 0.0 111.704 177.264 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -63.16 -53.47 52.81 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.369 0.668 . . . . 0.0 109.817 -177.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -66.45 -26.65 67.3 Favored 'General case' 0 N--CA 1.484 1.263 0 O-C-N 123.204 0.315 . . . . 0.0 111.689 178.221 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 17.4 ttm-85 -65.13 -47.97 75.25 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.536 0.734 . . . . 0.0 111.462 176.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.627 HD21 HD22 ' A' ' 66' ' ' LEU . 4.0 pp -82.19 -30.18 31.07 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-O 120.64 0.257 . . . . 0.0 110.557 -178.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 87.8 m-70 -89.02 20.91 3.36 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.576 0.75 . . . . 0.0 110.958 174.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.5 pttp -49.1 -34.32 13.68 Favored 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 113.891 1.071 . . . . 0.0 113.891 -176.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.605 ' H ' HD13 ' A' ' 30' ' ' ILE . 0.1 OUTLIER -60.99 -42.05 91.49 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.237 0 C-N-CA 123.972 0.909 . . . . 0.0 112.402 177.6 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -102.77 -15.3 16.31 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.581 0.752 . . . . 0.0 111.807 -176.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -115.19 53.15 0.83 Allowed 'General case' 0 N--CA 1.481 1.076 0 CA-C-O 122.635 1.207 . . . . 0.0 108.243 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -80.89 83.57 6.59 Favored 'General case' 0 CA--C 1.55 0.956 0 CA-C-N 113.244 -1.798 . . . . 0.0 111.087 -171.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -150.34 72.34 1.1 Allowed 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.446 1.099 . . . . 0.0 109.197 173.069 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -93.02 -5.05 51.43 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.438 0.695 . . . . 0.0 111.302 179.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -67.97 126.3 92.47 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 123.763 0.825 . . . . 0.0 109.965 -173.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -57.28 95.29 0.06 OUTLIER 'Trans proline' 0 C--N 1.385 2.495 0 C-N-CA 123.503 2.802 . . . . 0.0 112.444 -179.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 31.5 mmt180 58.88 91.89 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.095 1.358 . . . . 0.0 112.42 -177.281 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 -74.23 126.27 89.23 Favored Pre-proline 0 CA--C 1.554 1.119 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 166.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -68.84 -2.29 9.23 Favored 'Trans proline' 0 C--N 1.377 2.036 0 C-N-CA 122.983 2.455 . . . . 0.0 113.07 -175.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -135.59 96.45 3.45 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 170.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -111.93 -130.85 0.31 Allowed 'General case' 0 CA--C 1.551 0.991 0 CA-C-O 118.103 -0.951 . . . . 0.0 109.044 176.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 63.76 27.09 14.61 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 124.33 1.052 . . . . 0.0 109.94 -178.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -133.76 106.65 7.45 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.788 -174.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 4.8 mpt_? -119.42 40.69 3.29 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 170.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.51 74.45 0.77 Allowed 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.216 1.006 . . . . 0.0 111.27 -174.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.9 t -174.6 171.02 3.36 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.567 1.147 . . . . 0.0 109.184 -171.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 71.33 14.17 6.51 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 124.429 1.092 . . . . 0.0 111.428 177.141 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -72.08 -21.64 61.47 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.555 0.742 . . . . 0.0 111.061 178.38 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.3 m -91.01 -76.95 0.43 Allowed 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 172.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.3 t30 59.07 12.16 2.31 Favored 'General case' 0 CA--C 1.568 1.663 0 C-N-CA 124.909 1.284 . . . . 0.0 111.803 178.03 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -81.27 -33.28 32.8 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.743 0.817 . . . . 0.0 111.021 -171.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -74.91 146.4 41.85 Favored 'General case' 0 C--O 1.243 0.733 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.79 177.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 42.3 t -72.34 -52.6 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.777 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 30.2 tp 68.56 129.41 0.03 OUTLIER 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 125.348 1.459 . . . . 0.0 112.755 175.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -86.16 -11.59 52.14 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 124.049 0.94 . . . . 0.0 112.3 -178.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -81.62 3.85 23.72 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.437 0.695 . . . . 0.0 111.904 -178.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.437 HD13 HD13 ' A' ' 27' ' ' LEU . 11.1 mt -86.74 155.21 20.43 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 174.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -86.83 135.77 13.5 Favored Glycine 0 N--CA 1.467 0.723 0 CA-C-O 119.153 -0.804 . . . . 0.0 111.1 173.184 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -56.89 -51.7 68.05 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.441 1.097 . . . . 0.0 111.811 -176.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.5 t -65.34 -33.87 66.62 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 124.133 0.973 . . . . 0.0 110.117 178.212 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.614 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -64.43 -39.96 97.35 Favored Glycine 0 C--O 1.217 -0.927 0 O-C-N 123.487 0.492 . . . . 0.0 111.94 177.474 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -75.66 -38.37 58.84 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.373 1.069 . . . . 0.0 111.484 -178.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -80.75 -36.58 31.77 Favored 'General case' 0 N--CA 1.485 1.316 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.094 -173.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -69.85 -36.08 75.24 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 173.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.627 HD22 HD21 ' A' ' 27' ' ' LEU . 9.5 tp -57.86 -47.57 82.35 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.168 0.987 . . . . 0.0 109.839 171.796 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 38.8 ttt180 -56.92 -44.17 82.17 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.864 1.265 . . . . 0.0 111.193 177.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.8 -38.19 88.3 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.579 0.752 . . . . 0.0 110.749 179.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.668 HG21 ' HB3' ' A' ' 20' ' ' GLN . 74.6 mt -65.78 -50.65 69.37 Favored 'Isoleucine or valine' 0 C--N 1.351 0.647 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.332 177.217 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -68.92 -28.75 66.95 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.176 0.991 . . . . 0.0 111.617 -176.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.32 -44.91 77.99 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.469 0.707 . . . . 0.0 109.621 175.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.5 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -64.48 -45.78 85.86 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 114.76 -1.109 . . . . 0.0 110.633 177.257 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.624 HD23 HD12 ' A' ' 76' ' ' ILE . 92.6 mt -64.16 -34.28 77.7 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 124.479 1.112 . . . . 0.0 111.636 179.041 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.59 -42.17 98.47 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 123.985 0.803 . . . . 0.0 109.947 176.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 58.3 mtp85 -74.72 -25.43 59.12 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 114.804 -1.089 . . . . 0.0 111.881 178.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.624 HD12 HD23 ' A' ' 73' ' ' LEU . 47.6 mt -67.82 -44.93 85.15 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 CA-C-N 118.662 0.664 . . . . 0.0 109.957 175.077 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.34 -39.21 89.74 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 124.085 0.866 . . . . 0.0 110.379 174.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 27.5 t -78.3 -10.72 59.79 Favored 'General case' 0 CA--C 1.555 1.164 0 CA-C-N 115.074 -0.966 . . . . 0.0 111.725 179.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 77.0 10.22 86.37 Favored Glycine 0 C--N 1.351 1.411 0 N-CA-C 113.765 0.266 . . . . 0.0 113.765 178.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 7.5 t -117.87 27.98 8.69 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 124.724 1.21 . . . . 0.0 111.08 -179.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.457 ' HE1' ' HB1' ' A' ' 72' ' ' ALA . 80.1 t80 -53.43 149.14 8.01 Favored 'General case' 0 N--CA 1.485 1.313 0 O-C-N 121.901 -0.499 . . . . 0.0 111.867 170.58 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.54 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 69.52 41.83 75.05 Favored Glycine 0 C--O 1.212 -1.253 0 CA-C-N 114.619 -1.173 . . . . 0.0 111.149 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . 0.432 HG21 ' HB2' ' A' ' 1' ' ' LEU . 31.5 m -124.82 108.75 12.26 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-O 121.265 0.555 . . . . 0.0 109.629 176.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 51.4 t -62.52 98.6 0.12 Allowed 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 114.366 -1.288 . . . . 0.0 110.659 172.085 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 27.5 m -63.65 -23.71 34.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 O-C-N 124.381 1.05 . . . . 0.0 112.374 -175.019 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.494 ' HD3' ' HB3' ' A' ' 108' ' ' CYS . 47.0 tttm -67.76 -26.32 66.06 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.453 0.701 . . . . 0.0 112.046 -177.281 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 31.9 p -133.52 4.25 3.64 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 122.614 0.366 . . . . 0.0 111.648 179.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 61.08 28.42 68.9 Favored Glycine 0 C--N 1.351 1.395 0 N-CA-C 114.483 0.553 . . . . 0.0 114.483 -179.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 46.9 mtmt -116.38 166.27 12.26 Favored 'General case' 0 N--CA 1.487 1.404 0 CA-C-N 117.238 0.519 . . . . 0.0 110.67 -177.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.54 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 7.2 tpp180 -67.21 146.63 54.0 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 124.517 1.127 . . . . 0.0 111.116 177.078 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 10.5 mm -85.77 144.27 9.87 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 170.155 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 5.4 m -67.94 142.19 56.09 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 109.049 -0.722 . . . . 0.0 109.049 176.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -62.29 -29.14 70.22 Favored 'General case' 0 N--CA 1.484 1.272 0 CA-C-N 118.294 0.497 . . . . 0.0 109.976 174.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -57.0 -52.96 63.17 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.534 1.134 . . . . 0.0 111.248 169.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.57 -35.51 80.75 Favored 'General case' 0 C--O 1.214 -0.809 0 O-C-N 124.296 0.997 . . . . 0.0 110.011 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 89.4 mt -72.69 -40.39 66.26 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.467 0.707 . . . . 0.0 111.841 -179.288 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.411 ' HZ3' ' HB3' ' A' ' 97' ' ' LYS . 0.3 OUTLIER -75.01 -28.29 60.46 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -177.362 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.32 -43.5 50.5 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.973 0.909 . . . . 0.0 110.842 173.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.3 p -151.85 99.73 2.92 Favored Pre-proline 0 CA--C 1.554 1.098 0 C-N-CA 124.6 1.16 . . . . 0.0 108.876 -177.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -66.65 -24.87 47.5 Favored 'Trans proline' 0 C--N 1.373 1.86 0 C-N-CA 122.789 2.326 . . . . 0.0 113.434 179.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 28.4 p90 -93.36 54.63 2.11 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.134 0.974 . . . . 0.0 110.677 -178.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 4.1 t -112.76 103.52 55.61 Favored Pre-proline 0 CA--C 1.554 1.1 0 C-N-CA 123.434 0.694 . . . . 0.0 110.696 -179.066 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -76.26 -9.48 19.02 Favored 'Trans proline' 0 C--N 1.376 1.976 0 C-N-CA 122.852 2.368 . . . . 0.0 112.215 168.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -127.08 117.17 21.9 Favored 'General case' 0 C--N 1.359 1.005 0 C-N-CA 123.501 0.721 . . . . 0.0 110.31 -174.085 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 16.7 p -64.09 159.22 20.81 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 118.145 -0.931 . . . . 0.0 109.28 175.181 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -44.91 -39.38 5.39 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 124.313 1.045 . . . . 0.0 113.493 -169.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -58.09 -53.79 54.22 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.155 0.982 . . . . 0.0 111.217 176.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.494 ' HB3' ' HD3' ' A' ' 86' ' ' LYS . 85.0 m -73.4 -31.88 64.13 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 114.759 -1.109 . . . . 0.0 111.754 -176.376 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.9 -38.91 92.55 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.127 0.971 . . . . 0.0 110.507 176.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.75 -30.19 62.65 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.489 0.716 . . . . 0.0 110.876 174.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -79.42 -6.1 56.12 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.822 0.849 . . . . 0.0 112.453 -179.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 73.1 mt . . . . . 0 C--O 1.249 1.074 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 174.473 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.1 pt? . . . . . 0 N--CA 1.474 0.772 0 N-CA-C 109.684 -0.488 . . . . 0.0 109.684 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -90.96 142.37 27.84 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.288 0.635 . . . . 0.0 109.398 174.235 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 176.39 113.39 0.34 Allowed Glycine 0 C--N 1.34 0.766 0 N-CA-C 111.755 -0.538 . . . . 0.0 111.755 -178.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -84.69 99.82 2.33 Favored Glycine 0 C--N 1.345 1.076 0 N-CA-C 110.851 -0.9 . . . . 0.0 110.851 174.054 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.14 -45.7 90.27 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.032 0.933 . . . . 0.0 110.245 -178.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.8 m 66.39 -74.9 0.06 Allowed 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 125.366 1.466 . . . . 0.0 110.631 178.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 21.3 ptp -78.32 173.53 12.21 Favored 'General case' 0 C--O 1.242 0.69 0 C-N-CA 124.284 1.034 . . . . 0.0 110.534 175.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -77.66 79.33 4.16 Favored 'General case' 0 C--O 1.241 0.651 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 174.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 60.5 t -67.72 -33.94 64.8 Favored 'Isoleucine or valine' 0 C--N 1.347 0.482 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.225 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -65.34 -30.22 71.04 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 123.836 0.71 . . . . 0.0 111.697 179.003 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 47.5 m -65.88 -44.23 85.94 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 122.708 0.403 . . . . 0.0 110.061 173.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -67.95 -35.19 77.98 Favored 'General case' 0 C--O 1.217 -0.634 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.51 176.219 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.9 tm-20 -63.59 -55.31 24.77 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.299 1.039 . . . . 0.0 109.41 -176.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.422 ' HB2' ' HE3' ' A' ' 14' ' ' LYS . 15.4 ptmt -71.03 -35.46 71.99 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.252 -173.562 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.501 ' O ' ' HB2' ' A' ' 19' ' ' ARG . 12.3 tt -65.87 -33.95 67.02 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.551 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.55 ' HB3' HG23 ' A' ' 69' ' ' ILE . 69.6 mt -75.58 -34.05 60.64 Favored 'General case' 0 C--N 1.355 0.824 0 C-N-CA 123.952 0.901 . . . . 0.0 111.587 176.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.449 ' NH2' HD13 ' A' ' 73' ' ' LEU . 3.6 mmp_? -58.15 -49.91 75.35 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.097 0.559 . . . . 0.0 109.803 174.665 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -74.95 -27.93 60.38 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.02 0.528 . . . . 0.0 111.381 -179.01 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.501 ' HB2' ' O ' ' A' ' 15' ' ' ILE . 2.3 tpt180 -71.3 -41.98 69.26 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 123.622 0.577 . . . . 0.0 110.101 -178.217 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.621 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.5 pt20 -72.22 -30.35 64.83 Favored 'General case' 0 C--O 1.206 -1.22 0 CA-C-O 118.834 -0.603 . . . . 0.0 109.665 177.094 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.551 ' HB3' HH21 ' A' ' 25' ' ' ARG . 60.7 mtm-85 -68.43 -46.37 70.06 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.019 0.528 . . . . 0.0 111.999 179.66 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -63.58 -38.24 90.38 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 123.463 0.477 . . . . 0.0 110.428 177.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.565 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 81.5 mt -64.66 -48.77 73.57 Favored 'General case' 0 C--O 1.21 -0.981 0 O-C-N 123.495 0.497 . . . . 0.0 109.927 173.141 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.502 ' CE1' HD21 ' A' ' 66' ' ' LEU . 1.7 m-85 -57.41 -46.38 83.55 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.083 0.953 . . . . 0.0 110.871 -174.196 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.551 HH21 ' HB3' ' A' ' 21' ' ' ARG . 11.0 ptp180 -71.94 -28.11 63.24 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 122.747 0.419 . . . . 0.0 111.321 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 38.8 ttm180 -68.39 -56.52 8.21 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.435 0.694 . . . . 0.0 111.265 175.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 3.5 pp -80.88 -25.93 37.25 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.386 0.674 . . . . 0.0 111.51 -171.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.548 ' HB3' ' HG2' ' A' ' 31' ' ' GLU . 75.6 m-70 -86.63 34.55 0.65 Allowed 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 122.866 0.466 . . . . 0.0 110.109 169.676 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 20.8 pttp -50.7 -30.66 14.31 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 125.376 1.47 . . . . 0.0 112.398 170.526 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.5 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -69.78 -24.86 27.27 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.186 0 C-N-CA 123.834 0.854 . . . . 0.0 112.673 -178.15 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.548 ' HG2' ' HB3' ' A' ' 28' ' ' HIS . 10.5 pt-20 -105.58 -20.99 13.3 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.931 0.493 . . . . 0.0 110.377 173.393 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -78.41 112.58 15.59 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 179.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -75.57 -80.24 0.09 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.478 0.711 . . . . 0.0 110.904 -172.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -150.28 48.38 0.9 Allowed 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.662 0.785 . . . . 0.0 110.252 -177.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -83.47 -24.82 31.61 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.142 174.03 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 71.71 112.0 0.03 OUTLIER Pre-proline 0 CA--C 1.557 1.233 0 C-N-CA 125.493 1.517 . . . . 0.0 110.021 -172.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -62.52 105.02 0.39 Allowed 'Trans proline' 0 C--N 1.386 2.551 0 C-N-CA 123.141 2.561 . . . . 0.0 111.769 177.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 75.9 mtt180 -112.72 154.59 25.92 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.723 0.809 . . . . 0.0 110.765 -177.457 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -85.73 161.82 49.41 Favored Pre-proline 0 CA--C 1.556 1.198 0 C-N-CA 123.856 0.863 . . . . 0.0 109.392 175.229 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -65.71 87.85 0.22 Allowed 'Trans proline' 0 C--N 1.377 2.05 0 C-N-CA 122.668 2.245 . . . . 0.0 113.733 179.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -107.0 15.18 25.59 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.814 0.845 . . . . 0.0 108.957 163.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -85.01 162.48 19.34 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.255 1.422 . . . . 0.0 110.003 178.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -59.2 -73.93 0.08 Allowed 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.082 0.553 . . . . 0.0 110.293 173.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 28.0 t70 178.76 86.74 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.159 0.984 . . . . 0.0 109.837 -178.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 7.2 mpt_? -120.85 156.03 32.82 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.558 0.743 . . . . 0.0 109.67 171.455 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -94.98 15.68 18.14 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.943 0.897 . . . . 0.0 112.2 -177.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.6 m -62.93 97.66 0.11 Allowed 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 124.308 1.043 . . . . 0.0 112.012 -173.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -102.65 159.46 15.44 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.632 1.173 . . . . 0.0 112.181 -170.198 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 34.5 mmm-85 -128.91 44.32 2.99 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.475 1.11 . . . . 0.0 108.197 170.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.5 m -65.61 -74.4 0.11 Allowed 'General case' 0 C--N 1.352 0.676 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.652 -172.571 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 56.1 t30 58.87 110.76 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.49 1.116 . . . . 0.0 111.792 -179.491 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -75.79 79.31 2.72 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.023 0.929 . . . . 0.0 111.016 -176.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -159.21 154.47 25.42 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.417 1.487 . . . . 0.0 108.605 169.01 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 47.0 t -90.92 -86.81 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 CA-C-O 118.779 -0.629 . . . . 0.0 109.337 178.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.451 ' HG ' ' H ' ' A' ' 57' ' ' GLU . 54.6 tp 69.12 133.92 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 124.972 1.309 . . . . 0.0 110.116 -171.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -74.17 -3.33 29.14 Favored 'General case' 0 N--CA 1.492 1.625 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -175.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.451 ' H ' ' HG ' ' A' ' 55' ' ' LEU . 41.4 mt-10 -88.09 20.03 3.37 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 123.64 0.776 . . . . 0.0 111.867 -179.009 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.475 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 50.0 mt -85.95 -85.06 0.16 Allowed 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 110.516 -0.179 . . . . 0.0 110.516 174.718 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 151.07 139.75 3.05 Favored Glycine 0 C--N 1.346 1.1 0 CA-C-O 119.711 -0.494 . . . . 0.0 111.889 -178.532 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -57.2 -63.89 1.07 Allowed 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.774 1.23 . . . . 0.0 113.18 -170.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 60.4 t -59.82 -33.81 53.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 C-N-CA 124.39 1.076 . . . . 0.0 110.759 -177.294 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.536 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -63.68 -54.96 27.81 Favored Glycine 0 C--O 1.215 -1.082 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.766 177.232 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -67.87 -37.42 81.79 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 124.363 1.065 . . . . 0.0 112.092 -174.058 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -67.81 -46.07 72.96 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 123.901 0.75 . . . . 0.0 110.472 -179.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -70.17 -35.08 73.74 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.1 178.003 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.536 ' HB2' ' O ' ' A' ' 62' ' ' GLY . 11.9 tp -60.3 -46.3 90.36 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 124.943 1.297 . . . . 0.0 110.459 -179.306 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -66.64 -39.74 88.41 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 124.632 1.207 . . . . 0.0 110.674 178.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.415 ' HB1' ' O ' ' A' ' 101' ' ' TYR . . . -64.03 -39.99 95.32 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.673 0.789 . . . . 0.0 110.849 179.282 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.621 HG21 ' HB3' ' A' ' 20' ' ' GLN . 89.4 mt -66.87 -46.03 86.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-N 114.841 -1.072 . . . . 0.0 109.745 176.361 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -65.03 -33.12 75.28 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.063 0.945 . . . . 0.0 111.271 -177.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.58 -44.07 75.18 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.626 0.77 . . . . 0.0 110.275 178.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.426 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -63.45 -49.97 71.56 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.893 178.573 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.453 HD23 HD12 ' A' ' 76' ' ' ILE . 69.1 mt -61.23 -38.24 85.93 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.805 1.242 . . . . 0.0 112.246 179.038 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.55 -42.54 98.99 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.423 0.689 . . . . 0.0 110.485 177.338 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 86.8 mtt-85 -75.24 -21.85 58.29 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 114.761 -1.109 . . . . 0.0 112.369 -178.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.453 HD12 HD23 ' A' ' 73' ' ' LEU . 89.6 mt -67.24 -47.82 80.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 171.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -67.2 -30.64 70.64 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.362 178.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 29.1 t -80.48 -23.6 40.06 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.652 0.781 . . . . 0.0 111.113 177.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 87.99 7.29 74.29 Favored Glycine 0 C--N 1.35 1.333 0 C-N-CA 123.039 0.352 . . . . 0.0 113.657 -178.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.3 t -113.12 29.03 8.31 Favored 'General case' 0 CA--C 1.556 1.2 0 C-N-CA 124.082 0.953 . . . . 0.0 110.413 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -64.22 146.12 54.83 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 122.729 0.412 . . . . 0.0 110.413 169.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.503 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 74.36 31.32 59.28 Favored Glycine 0 C--N 1.341 0.842 0 O-C-N 123.82 0.7 . . . . 0.0 112.298 -177.748 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 26.6 m -117.89 110.85 18.25 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 122.887 0.475 . . . . 0.0 110.215 176.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.453 ' HB2' HD13 ' A' ' 91' ' ' ILE . 44.0 t -77.57 95.64 4.59 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.154 0.981 . . . . 0.0 110.101 174.728 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 30.9 m -62.56 -30.77 49.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 O-C-N 124.138 0.898 . . . . 0.0 113.077 -175.44 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.543 ' HE3' HD21 ' A' ' 112' ' ' LEU . 22.7 ttmm -60.56 -32.19 71.28 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.439 0.696 . . . . 0.0 112.535 -176.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.531 ' SG ' ' HB2' ' A' ' 89' ' ' LYS . 28.7 p -119.83 1.73 11.02 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 122.45 0.3 . . . . 0.0 111.273 175.342 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 62.76 20.82 62.38 Favored Glycine 0 C--N 1.351 1.39 0 CA-C-O 120.065 -0.297 . . . . 0.0 113.388 -177.069 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.531 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 11.0 mmpt? -106.46 177.06 4.97 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.48 0.712 . . . . 0.0 110.534 -176.689 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.503 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 21.8 tpp85 -78.83 144.97 34.53 Favored 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 124.197 0.999 . . . . 0.0 110.415 177.409 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.453 HD13 ' HB2' ' A' ' 84' ' ' CYS . 5.3 mm -79.94 144.89 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 168.297 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 19.7 m -74.55 149.31 40.23 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 110.403 -0.221 . . . . 0.0 110.403 178.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.443 ' HG2' ' HE3' ' A' ' 97' ' ' LYS . 30.6 tt0 -60.07 -42.96 95.68 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.854 0.862 . . . . 0.0 110.598 174.09 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -57.21 -43.7 83.03 Favored 'General case' 0 N--CA 1.482 1.151 0 O-C-N 124.497 1.123 . . . . 0.0 110.546 176.414 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.549 ' HG3' HG21 ' A' ' 102' ' ' THR . 26.5 tpt180 -64.43 -43.37 94.54 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 114.488 -1.233 . . . . 0.0 110.869 179.074 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 75.2 mt -71.46 -33.68 69.54 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.302 0.641 . . . . 0.0 112.624 -176.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.443 ' HE3' ' HG2' ' A' ' 93' ' ' GLU . 16.4 ptpt -79.75 -27.74 40.51 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 122.248 -0.283 . . . . 0.0 110.56 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -80.34 -33.66 37.22 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.859 0.864 . . . . 0.0 111.21 177.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.4 p -157.57 97.04 1.98 Allowed Pre-proline 0 CA--C 1.556 1.197 0 C-N-CA 124.78 1.232 . . . . 0.0 108.248 179.187 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -75.28 -8.81 20.06 Favored 'Trans proline' 0 C--N 1.377 2.067 0 C-N-CA 122.671 2.248 . . . . 0.0 113.724 -179.342 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . 0.415 ' O ' ' HB1' ' A' ' 68' ' ' ALA . 35.1 p90 -105.74 45.6 0.96 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.434 0.693 . . . . 0.0 110.991 -178.268 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.549 HG21 ' HG3' ' A' ' 95' ' ' ARG . 15.2 t -116.92 101.79 53.28 Favored Pre-proline 0 CA--C 1.564 1.508 0 CA-C-O 121.149 0.5 . . . . 0.0 110.216 -178.56 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.436 ' O ' ' HA ' ' A' ' 84' ' ' CYS . 32.4 Cg_exo -64.83 -24.54 61.22 Favored 'Trans proline' 0 C--N 1.378 2.109 0 C-N-CA 122.898 2.399 . . . . 0.0 113.317 174.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.401 ' HA ' ' SG ' ' A' ' 84' ' ' CYS . 6.6 m-85 -114.64 148.74 37.71 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.833 0.853 . . . . 0.0 109.297 -178.694 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.502 ' SG ' ' OE1' ' A' ' 107' ' ' GLU . 28.5 p -83.54 165.7 18.87 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 -178.482 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -46.78 -41.86 16.06 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 124.793 1.237 . . . . 0.0 114.204 -162.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.502 ' OE1' ' SG ' ' A' ' 105' ' ' CYS . 0.0 OUTLIER -82.95 -23.61 33.37 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-O 120.647 0.261 . . . . 0.0 111.556 -175.982 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.536 ' HB3' ' HD2' ' A' ' 86' ' ' LYS . 97.7 m -76.54 -29.83 56.87 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.23 1.012 . . . . 0.0 110.951 174.288 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -78.13 -34.57 49.84 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.505 0.722 . . . . 0.0 109.866 174.46 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.55 -21.72 61.12 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.874 0.87 . . . . 0.0 111.151 174.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -73.57 -26.79 60.99 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.778 0.831 . . . . 0.0 111.733 176.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.543 HD21 ' HE3' ' A' ' 86' ' ' LYS . 88.2 mt . . . . . 0 CA--C 1.553 1.085 0 C-N-CA 123.877 0.871 . . . . 0.0 110.623 -178.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 10.1 mp . . . . . 0 N--CA 1.478 0.943 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 77.82 -24.9 0.21 Allowed 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 125.835 1.654 . . . . 0.0 113.206 178.537 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 73.22 1.42 56.84 Favored Glycine 0 C--N 1.349 1.273 0 CA-C-O 119.658 -0.523 . . . . 0.0 113.76 -178.337 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 80.39 -57.12 4.69 Favored Glycine 0 C--N 1.355 1.589 0 C-N-CA 123.287 0.47 . . . . 0.0 112.733 -173.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.05 -169.46 3.26 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.018 0.927 . . . . 0.0 109.64 -175.035 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.1 t 71.11 -172.52 0.16 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.332 1.053 . . . . 0.0 111.768 169.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . 0.436 ' HG2' ' HE2' ' A' ' 12' ' ' TYR . 60.2 ttp -58.31 -62.25 1.98 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.33 1.052 . . . . 0.0 110.685 178.561 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 62.6 t30 57.68 103.49 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 125.689 1.596 . . . . 0.0 112.547 178.41 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 99.4 t -59.4 -34.0 53.0 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.079 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.145 177.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -58.4 -43.81 88.76 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 124.465 1.106 . . . . 0.0 112.249 -179.294 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.9 m -57.68 -40.38 79.29 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.031 0.532 . . . . 0.0 110.262 177.588 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.516 ' HA ' HG22 ' A' ' 15' ' ' ILE . 25.2 m-85 -75.62 -34.81 60.59 Favored 'General case' 0 C--O 1.214 -0.799 0 CA-C-N 115.1 -0.955 . . . . 0.0 110.816 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -57.53 -53.23 60.45 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.407 1.083 . . . . 0.0 110.089 -177.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.423 ' NZ ' ' HB2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -71.72 -42.75 66.93 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.711 -176.701 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.516 HG22 ' HA ' ' A' ' 12' ' ' TYR . 11.6 tt -62.92 -34.25 65.11 Favored 'Isoleucine or valine' 0 C--N 1.37 1.489 0 CA-C-N 118.588 0.631 . . . . 0.0 110.083 -177.13 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.578 ' HB3' HG23 ' A' ' 69' ' ' ILE . 56.9 mt -65.13 -43.2 92.69 Favored 'General case' 0 C--N 1.345 0.406 0 C-N-CA 123.224 0.609 . . . . 0.0 110.898 175.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.423 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 97.4 mtt180 -63.87 -47.46 80.57 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 123.717 0.636 . . . . 0.0 111.88 177.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -63.71 -42.57 97.93 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 122.976 0.51 . . . . 0.0 111.204 -178.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -39.97 81.05 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.786 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.671 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.2 pt20 -70.16 -35.37 73.96 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 119.301 -0.381 . . . . 0.0 110.535 -178.706 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 71.1 mtp180 -69.47 -41.5 76.12 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.588 0.755 . . . . 0.0 111.363 -175.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -66.68 -34.41 77.81 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 175.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.602 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 86.1 mt -69.42 -38.53 77.94 Favored 'General case' 0 C--O 1.216 -0.671 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.924 174.763 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -60.85 -46.31 91.09 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 122.992 0.517 . . . . 0.0 110.304 -177.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 -69.95 -31.52 69.3 Favored 'General case' 0 N--CA 1.483 1.197 0 O-C-N 123.492 0.495 . . . . 0.0 110.634 178.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.42 ' O ' ' HE3' ' A' ' 29' ' ' LYS . 21.7 ttt85 -62.38 -59.48 4.94 Favored 'General case' 0 C--N 1.361 1.091 0 C-N-CA 123.533 0.733 . . . . 0.0 111.439 177.191 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.602 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 1.1 pp -80.19 -24.48 40.28 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 112.505 0.558 . . . . 0.0 112.505 -173.36 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -91.26 28.04 1.76 Allowed 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 123.04 0.536 . . . . 0.0 109.693 174.436 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.42 ' HE3' ' O ' ' A' ' 26' ' ' ARG . 7.6 ptpp? -49.53 -30.55 8.62 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 125.265 1.426 . . . . 0.0 113.484 -178.535 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.459 HD13 ' H ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -62.85 -36.3 74.93 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 123.864 0.866 . . . . 0.0 112.206 -177.9 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -106.07 -25.82 11.89 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.915 0.886 . . . . 0.0 110.733 -178.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -91.95 107.48 19.24 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.873 0.869 . . . . 0.0 110.009 -174.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -69.61 -22.55 63.49 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 123.451 0.7 . . . . 0.0 110.499 174.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -76.32 95.28 3.74 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.661 0.784 . . . . 0.0 110.245 174.337 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -78.02 -61.17 2.08 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 167.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 60.02 93.74 0.05 OUTLIER Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 125.422 1.489 . . . . 0.0 112.321 177.601 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -72.03 -158.59 0.06 OUTLIER 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 122.775 2.317 . . . . 0.0 111.697 173.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -70.52 93.66 0.92 Allowed 'General case' 0 N--CA 1.481 1.096 0 CA-C-O 121.486 0.66 . . . . 0.0 110.76 -178.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -114.32 149.12 41.57 Favored Pre-proline 0 CA--C 1.541 0.598 0 C-N-CA 124.314 1.046 . . . . 0.0 108.433 174.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_exo -58.96 -51.92 6.01 Favored 'Trans proline' 0 C--N 1.373 1.821 0 C-N-CA 122.332 2.021 . . . . 0.0 110.915 171.188 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.1 t70 64.98 166.92 0.17 Allowed 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 125.046 1.339 . . . . 0.0 110.927 -178.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -87.53 -44.95 10.89 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.032 0.533 . . . . 0.0 110.872 178.557 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -176.34 -37.08 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.646 1.178 . . . . 0.0 110.414 179.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 55.5 t0 65.4 110.47 0.03 OUTLIER 'General case' 0 C--N 1.356 0.857 0 C-N-CA 125.482 1.513 . . . . 0.0 110.298 -167.178 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 21.5 ttp180 -134.4 5.15 3.46 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 124.575 1.15 . . . . 0.0 108.904 176.476 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -91.08 -29.67 17.19 Favored 'General case' 0 C--N 1.356 0.884 0 C-N-CA 123.481 0.713 . . . . 0.0 111.301 -176.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.6 p -70.32 88.33 0.64 Allowed 'General case' 0 C--N 1.36 1.027 0 CA-C-O 122.141 0.972 . . . . 0.0 110.392 177.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.61 ' HG3' ' HG3' ' A' ' 49' ' ' ARG . 7.6 pt-20 -96.16 -161.5 0.87 Allowed 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 113.951 -1.477 . . . . 0.0 109.664 177.185 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.61 ' HG3' ' HG3' ' A' ' 48' ' ' GLU . 95.3 mtt180 72.46 117.42 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 125.219 1.408 . . . . 0.0 111.724 173.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 34.8 p -83.7 116.21 22.55 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 169.386 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -68.59 96.32 0.7 Allowed 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.115 0.566 . . . . 0.0 111.263 -178.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -69.74 -35.97 75.45 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.103 172.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -66.41 131.83 46.94 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.277 171.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 33.8 t -91.49 -70.54 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 170.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.478 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 37.4 tp 61.84 106.57 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.594 1.158 . . . . 0.0 110.239 -177.2 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -68.14 13.23 0.09 Allowed 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 114.883 1.438 . . . . 0.0 114.883 -168.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -77.65 -2.61 36.84 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.051 0.54 . . . . 0.0 111.048 168.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 8.8 mt -72.93 136.06 45.14 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 170.5 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -70.3 149.08 46.68 Favored Glycine 0 N--CA 1.472 1.087 0 CA-C-O 119.227 -0.763 . . . . 0.0 112.45 -177.234 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -50.72 -60.31 3.18 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.725 1.21 . . . . 0.0 112.51 -175.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.43 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 12.4 p -56.81 -35.03 44.95 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 123.202 0.601 . . . . 0.0 111.377 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -67.86 -41.13 88.98 Favored Glycine 0 C--N 1.347 1.165 0 O-C-N 123.883 0.739 . . . . 0.0 112.665 177.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -68.87 -43.78 74.64 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.629 0.771 . . . . 0.0 110.695 -177.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -68.2 -33.09 73.78 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.588 0.755 . . . . 0.0 110.749 178.144 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.43 ' HB2' ' O ' ' A' ' 61' ' ' VAL . 2.7 tp10 -69.79 -46.75 65.05 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.609 179.608 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.7 mp -60.59 -39.44 88.1 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 124.356 1.035 . . . . 0.0 110.47 174.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 74.0 ttt180 -64.24 -39.61 94.31 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.311 -179.124 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.19 -43.11 65.02 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.921 0.889 . . . . 0.0 110.985 178.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.671 HG21 ' HB3' ' A' ' 20' ' ' GLN . 69.9 mt -64.5 -55.86 19.22 Favored 'Isoleucine or valine' 0 C--N 1.356 0.855 0 C-N-CA 123.507 0.723 . . . . 0.0 110.174 -177.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -66.71 -25.29 66.45 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.089 0.955 . . . . 0.0 112.304 -179.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.17 -51.93 58.09 Favored 'General case' 0 N--CA 1.482 1.175 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 171.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.525 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -60.43 -42.42 96.03 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.317 1.047 . . . . 0.0 111.007 -179.042 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.501 HD23 HD12 ' A' ' 76' ' ' ILE . 88.1 mt -64.19 -39.41 93.94 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 124.56 1.144 . . . . 0.0 111.619 178.537 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.12 -37.66 88.17 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.383 0.673 . . . . 0.0 110.558 175.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.407 HH12 HG21 ' A' ' 85' ' ' VAL . 69.6 mtt-85 -73.05 -26.44 61.29 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.701 0.8 . . . . 0.0 111.055 178.494 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.525 HG13 ' O ' ' A' ' 72' ' ' ALA . 90.0 mt -66.33 -48.76 79.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 174.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.62 -35.17 80.04 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.909 179.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.8 t -78.19 -14.94 59.25 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 123.794 0.837 . . . . 0.0 111.437 177.2 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 82.23 6.19 88.99 Favored Glycine 0 C--N 1.351 1.385 0 C-N-CA 123.24 0.448 . . . . 0.0 113.908 177.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.5 t -104.28 15.17 28.87 Favored 'General case' 0 CA--C 1.555 1.172 0 C-N-CA 124.311 1.045 . . . . 0.0 111.323 -177.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -67.16 151.85 46.81 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 169.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 72.29 20.58 79.3 Favored Glycine 0 C--N 1.344 1.009 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.775 -176.473 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 30.5 m -128.12 111.37 13.4 Favored 'General case' 0 C--N 1.353 0.742 0 C-N-CA 124.179 0.992 . . . . 0.0 109.65 178.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.444 ' HB2' HD13 ' A' ' 91' ' ' ILE . 44.2 t -72.71 93.18 1.62 Allowed 'General case' 0 C--O 1.244 0.769 0 C-N-CA 123.878 0.871 . . . . 0.0 110.094 173.13 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.407 HG21 HH12 ' A' ' 75' ' ' ARG . 25.6 m -61.07 -24.4 32.97 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 CA-C-N 114.438 -1.255 . . . . 0.0 112.843 -178.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 47.7 tttm -71.9 -14.79 62.04 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.055 0.542 . . . . 0.0 112.116 -176.204 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.467 ' SG ' ' HB2' ' A' ' 89' ' ' LYS . 27.7 p -137.11 5.57 2.79 Favored 'General case' 0 N--CA 1.486 1.374 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 173.322 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 65.04 17.2 63.07 Favored Glycine 0 C--N 1.357 1.728 0 N-CA-C 113.819 0.288 . . . . 0.0 113.819 -178.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.467 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 31.8 mmmt -101.34 165.19 11.4 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.756 0.822 . . . . 0.0 109.415 -179.028 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 25.6 mmt180 -80.41 149.6 30.1 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 123.001 0.521 . . . . 0.0 110.42 172.079 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.444 HD13 ' HB2' ' A' ' 84' ' ' CYS . 5.3 mm -78.16 145.62 9.5 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 172.558 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 17.2 m -75.21 151.39 38.45 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.127 0.571 . . . . 0.0 109.744 177.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -64.25 -41.06 97.12 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 122.624 0.37 . . . . 0.0 110.672 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.456 ' HA ' ' HG2' ' A' ' 97' ' ' LYS . 24.7 m-20 -71.44 -31.71 67.51 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 123.771 0.67 . . . . 0.0 111.213 -179.465 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.422 ' HE ' HG21 ' A' ' 102' ' ' THR . 29.0 tpt180 -64.02 -37.17 86.44 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.433 0.693 . . . . 0.0 110.588 170.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 55.6 mt -77.68 -40.91 39.96 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.175 0.59 . . . . 0.0 112.278 -178.484 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.456 ' HG2' ' HA ' ' A' ' 94' ' ' ASP . 15.2 ptpt -70.79 -27.61 64.04 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-O 120.757 0.313 . . . . 0.0 110.223 -177.295 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.7 -50.69 8.99 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.693 0.797 . . . . 0.0 110.755 173.234 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.411 ' O ' HG22 ' A' ' 102' ' ' THR . 0.5 OUTLIER -130.2 86.0 55.34 Favored Pre-proline 0 CA--C 1.558 1.275 0 C-N-CA 124.087 0.955 . . . . 0.0 108.724 -175.449 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -77.89 -7.15 16.37 Favored 'Trans proline' 0 C--N 1.37 1.707 0 C-N-CA 122.383 2.055 . . . . 0.0 114.077 -177.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 16.3 p90 -103.12 -8.63 20.34 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -176.567 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.422 HG21 ' HE ' ' A' ' 95' ' ' ARG . 15.1 t -73.5 125.28 90.74 Favored Pre-proline 0 CA--C 1.56 1.331 0 CA-C-N 117.896 0.316 . . . . 0.0 110.398 -175.546 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -79.15 -7.91 15.25 Favored 'Trans proline' 0 C--N 1.371 1.724 0 C-N-CA 122.517 2.145 . . . . 0.0 111.98 172.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -116.32 140.08 49.71 Favored 'General case' 0 C--N 1.353 0.723 0 C-N-CA 123.855 0.862 . . . . 0.0 110.281 -175.157 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 20.6 p -75.43 167.09 22.56 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 174.508 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -50.55 -41.49 54.19 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.798 0.839 . . . . 0.0 112.106 -174.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -65.48 -44.27 87.64 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.2 1.0 . . . . 0.0 110.396 -175.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.417 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 86.8 m -69.26 -39.34 78.49 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.23 0.612 . . . . 0.0 111.103 177.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.88 -30.99 71.68 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.576 0.75 . . . . 0.0 111.399 177.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -74.46 -34.69 63.21 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.893 0.877 . . . . 0.0 110.598 174.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -77.02 -14.38 59.84 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 123.881 0.872 . . . . 0.0 111.939 178.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 108' ' ' CYS . 94.5 mt . . . . . 0 N--CA 1.479 0.996 0 CA-C-O 118.237 -0.887 . . . . 0.0 109.426 172.214 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 7.4 mp . . . . . 0 N--CA 1.476 0.866 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 65.64 -88.16 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 125.258 1.423 . . . . 0.0 112.305 -179.394 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 72.99 -80.84 0.69 Allowed Glycine 0 C--N 1.346 1.131 0 N-CA-C 111.824 -0.51 . . . . 0.0 111.824 -173.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 70.64 -112.08 4.09 Favored Glycine 0 C--N 1.353 1.518 0 CA-C-O 119.692 -0.505 . . . . 0.0 112.932 178.391 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 65.6 mttm 63.32 -164.39 0.25 Allowed 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 124.977 1.311 . . . . 0.0 112.675 175.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.7 p -59.5 -32.51 70.35 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.079 0.951 . . . . 0.0 111.498 173.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 56.8 ttp -156.1 134.43 11.49 Favored 'General case' 0 C--O 1.242 0.676 0 C-N-CA 124.454 1.102 . . . . 0.0 108.282 176.156 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 15.9 p-10 -70.86 81.65 0.64 Allowed 'General case' 0 CA--C 1.548 0.874 0 CA-C-O 121.9 0.857 . . . . 0.0 110.273 176.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 42.5 t -69.69 -27.56 34.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.485 -179.302 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -52.98 -38.49 62.24 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.073 0.949 . . . . 0.0 111.695 179.399 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 16.6 m -60.42 -43.48 96.71 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.932 175.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.459 ' HA ' HG22 ' A' ' 15' ' ' ILE . 25.4 m-85 -72.18 -32.69 67.05 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.996 179.663 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.608 ' HG2' HD13 ' A' ' 76' ' ' ILE . 39.5 mt-10 -59.3 -56.25 24.44 Favored 'General case' 0 N--CA 1.492 1.636 0 CA-C-O 121.434 0.635 . . . . 0.0 110.809 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -66.47 -44.44 82.71 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.134 -176.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.459 HG22 ' HA ' ' A' ' 12' ' ' TYR . 10.3 tt -67.49 -32.7 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.242 0 C-N-CA 122.514 0.326 . . . . 0.0 110.574 -174.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.535 ' HB3' HG23 ' A' ' 69' ' ' ILE . 31.2 mt -65.2 -46.09 82.15 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.093 0.557 . . . . 0.0 110.635 175.103 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 51.2 mtm-85 -63.82 -41.91 97.77 Favored 'General case' 0 C--O 1.217 -0.628 0 O-C-N 123.605 0.566 . . . . 0.0 110.81 179.402 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -61.54 -36.27 80.1 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.317 0.647 . . . . 0.0 111.218 177.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -81.15 -28.84 34.89 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.258 -178.535 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.642 ' HB3' HG21 ' A' ' 69' ' ' ILE . 2.4 pt20 -78.04 -25.09 47.62 Favored 'General case' 0 C--O 1.207 -1.16 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 173.546 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 72.9 mtt180 -66.82 -49.48 65.67 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.056 0.542 . . . . 0.0 110.589 176.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -65.75 -37.46 86.42 Favored 'General case' 0 N--CA 1.478 0.968 0 O-C-N 123.533 0.521 . . . . 0.0 110.88 178.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.59 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 58.0 mt -67.96 -46.23 71.97 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 119.155 -0.45 . . . . 0.0 111.147 175.411 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.422 ' O ' ' HB2' ' A' ' 28' ' ' HIS . 3.8 m-85 -58.13 -50.53 73.18 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.173 0.589 . . . . 0.0 110.094 -177.579 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 19.7 ptt180 -68.79 -28.15 66.51 Favored 'General case' 0 N--CA 1.48 1.057 0 O-C-N 123.525 0.515 . . . . 0.0 111.172 -178.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.455 ' O ' ' HE3' ' A' ' 29' ' ' LYS . 14.8 ttm180 -62.97 -59.05 5.35 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.083 0.553 . . . . 0.0 110.403 175.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.59 ' HG ' ' O ' ' A' ' 23' ' ' LEU . 1.6 pp -80.99 -8.37 59.76 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.986 -176.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.462 ' HB3' ' HG2' ' A' ' 31' ' ' GLU . 17.9 m170 -112.11 53.76 0.72 Allowed 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 170.83 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.455 ' HE3' ' O ' ' A' ' 26' ' ' ARG . 5.1 ptpp? -72.06 -19.59 61.8 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.012 -177.201 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.518 HD12 ' HG3' ' A' ' 57' ' ' GLU . 0.2 OUTLIER -61.87 -38.41 80.53 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.204 0.602 . . . . 0.0 111.525 175.421 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.462 ' HG2' ' HB3' ' A' ' 28' ' ' HIS . 12.7 pt-20 -94.4 -28.82 15.31 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.093 0.557 . . . . 0.0 110.32 178.261 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -89.02 75.36 7.98 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 122.002 0.906 . . . . 0.0 109.179 174.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -92.29 13.8 18.24 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 114.256 -1.338 . . . . 0.0 110.744 -177.026 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 27.1 t80 68.08 29.73 6.18 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 124.938 1.295 . . . . 0.0 109.871 -172.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -94.01 11.1 30.89 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.515 1.126 . . . . 0.0 109.827 169.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -64.53 155.16 82.23 Favored Pre-proline 0 CA--C 1.552 1.056 0 C-N-CA 125.422 1.489 . . . . 0.0 111.325 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.411 ' HG3' ' HB2' ' A' ' 44' ' ' ASP . 15.9 Cg_endo -54.77 123.77 14.56 Favored 'Trans proline' 0 C--N 1.382 2.292 0 C-N-CA 122.803 2.335 . . . . 0.0 112.116 177.653 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 42.0 mtp180 -65.92 -30.5 71.1 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.634 0.773 . . . . 0.0 111.24 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -78.99 118.71 74.01 Favored Pre-proline 0 CA--C 1.547 0.829 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 170.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -63.7 103.55 0.4 Allowed 'Trans proline' 0 C--N 1.378 2.099 0 C-N-CA 122.948 2.432 . . . . 0.0 112.714 -171.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -133.92 148.39 51.2 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 174.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 56.1 m-20 -83.08 -27.54 30.15 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.212 0.605 . . . . 0.0 112.139 -172.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -125.3 -30.7 3.12 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.387 0.675 . . . . 0.0 111.546 -171.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.411 ' HB2' ' HG3' ' A' ' 37' ' ' PRO . 24.5 t70 58.23 -84.68 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.562 1.145 . . . . 0.0 110.721 -171.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 42.7 ttp180 171.83 71.33 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.297 1.839 . . . . 0.0 106.295 177.466 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -159.06 90.06 0.96 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.073 -177.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 31.4 p -151.43 -61.93 0.18 Allowed 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 175.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.552 ' HG2' ' HG3' ' A' ' 49' ' ' ARG . 28.9 tt0 64.39 -81.88 0.03 OUTLIER 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 124.811 1.244 . . . . 0.0 112.32 172.717 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.552 ' HG3' ' HG2' ' A' ' 48' ' ' GLU . 24.5 mtp180 -130.42 -174.18 3.27 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 124.327 1.051 . . . . 0.0 110.66 -173.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 27.6 m -66.0 124.78 23.47 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 123.884 0.873 . . . . 0.0 112.037 -176.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -131.95 107.4 8.67 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.162 0.985 . . . . 0.0 108.845 174.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -118.56 70.76 0.82 Allowed 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 178.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -99.64 103.51 15.21 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.13 176.166 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 97.6 t -77.37 -71.27 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 173.046 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 96.1 mt 75.34 164.87 0.27 Allowed 'General case' 0 N--CA 1.489 1.525 0 C-N-CA 125.761 1.624 . . . . 0.0 112.05 -174.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -92.55 17.29 10.33 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 122.431 1.11 . . . . 0.0 109.392 170.046 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.518 ' HG3' HD12 ' A' ' 30' ' ' ILE . 0.6 OUTLIER -83.97 -13.01 54.42 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 126.203 1.801 . . . . 0.0 110.164 -175.207 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.535 HD22 HD13 ' A' ' 27' ' ' LEU . 4.6 mt -94.38 160.83 14.49 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.402 -165.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -97.53 161.71 21.36 Favored Glycine 0 N--CA 1.478 1.452 0 CA-C-O 119.493 -0.615 . . . . 0.0 112.181 173.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -64.77 -64.3 0.91 Allowed 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.231 0.612 . . . . 0.0 111.722 -173.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 9.3 p -59.32 -29.76 42.64 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 C-N-CA 123.89 0.876 . . . . 0.0 110.726 177.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.522 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -60.45 -51.73 56.96 Favored Glycine 0 C--N 1.348 1.25 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.164 175.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -69.9 -40.72 75.45 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.714 0.806 . . . . 0.0 112.024 -177.307 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -67.04 -44.05 81.19 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 123.92 0.763 . . . . 0.0 110.264 -174.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -70.43 -38.44 74.57 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.235 177.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.554 HD22 HD21 ' A' ' 27' ' ' LEU . 14.9 tp -58.23 -46.26 86.22 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 124.738 1.215 . . . . 0.0 111.137 178.525 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 31.1 ttt180 -75.94 -31.84 59.28 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 114.004 -1.453 . . . . 0.0 110.024 -175.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -68.28 -39.35 82.17 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 123.915 0.759 . . . . 0.0 110.717 174.533 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.642 HG21 ' HB3' ' A' ' 20' ' ' GLN . 80.9 mt -63.51 -47.7 90.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.523 0.729 . . . . 0.0 109.569 175.46 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -63.37 -35.59 80.91 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.813 -179.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.15 -39.99 75.02 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.757 0.823 . . . . 0.0 110.971 177.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.498 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -68.1 -43.3 78.78 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.61 0.764 . . . . 0.0 110.746 -179.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 84.7 mt -61.38 -39.11 89.46 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.288 1.035 . . . . 0.0 111.164 175.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.61 -37.12 86.49 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.624 175.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 67.3 mtt85 -69.98 -29.04 66.03 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.599 0.76 . . . . 0.0 111.509 176.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.608 HD13 ' HG2' ' A' ' 13' ' ' GLU . 62.3 mt -70.3 -44.79 77.3 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 177.394 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.89 -27.41 67.48 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 115.329 -0.851 . . . . 0.0 111.218 176.513 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.9 t -84.13 -18.23 37.46 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.729 0.812 . . . . 0.0 110.804 174.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 82.42 7.94 86.91 Favored Glycine 0 C--N 1.348 1.229 0 C-N-CA 123.084 0.373 . . . . 0.0 113.937 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.2 t -112.95 31.32 6.49 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 124.196 0.998 . . . . 0.0 110.402 -179.029 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -64.5 146.55 54.39 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.714 170.509 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.478 ' O ' ' HD3' ' A' ' 90' ' ' ARG . . . 73.16 37.03 55.76 Favored Glycine 0 C--N 1.343 0.933 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.955 -177.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 41.0 m -121.73 116.27 24.21 Favored 'General case' 0 C--O 1.242 0.679 0 C-N-CA 123.279 0.632 . . . . 0.0 109.668 177.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 44.4 t -67.33 102.29 1.07 Allowed 'General case' 0 C--N 1.349 0.563 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 169.076 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 33.7 m -63.43 -30.28 49.39 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 O-C-N 124.242 0.964 . . . . 0.0 111.947 -177.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -73.66 -13.7 61.03 Favored 'General case' 0 CA--C 1.557 1.241 0 C-N-CA 123.609 0.763 . . . . 0.0 111.432 177.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 57.5 m -111.17 -23.29 10.96 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.768 0.827 . . . . 0.0 111.534 175.038 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 64.56 20.87 66.34 Favored Glycine 0 CA--C 1.537 1.464 0 CA-C-N 116.545 -0.298 . . . . 0.0 112.986 -165.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 46.6 mtmt -126.89 -177.56 4.07 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.978 0.911 . . . . 0.0 110.491 -172.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.478 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 18.7 tpp180 -72.9 152.67 41.34 Favored 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 124.663 1.185 . . . . 0.0 111.658 -178.192 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 17.6 mm -92.72 149.68 4.11 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.017 0 C-N-CA 124.978 1.311 . . . . 0.0 109.406 170.371 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.3 m -64.59 145.13 56.61 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 122.965 0.506 . . . . 0.0 110.25 174.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -58.5 -42.81 88.51 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.257 0.623 . . . . 0.0 110.839 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.501 ' HA ' ' HG2' ' A' ' 97' ' ' LYS . 16.2 m-20 -68.31 -33.11 73.73 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.83 -179.659 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.409 ' HG3' HG21 ' A' ' 102' ' ' THR . 24.6 tpt180 -68.35 -31.78 71.42 Favored 'General case' 0 CA--C 1.547 0.864 0 O-C-N 123.635 0.584 . . . . 0.0 110.217 173.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.41 HD21 ' HA2' ' A' ' 82' ' ' GLY . 90.9 mt -80.34 -37.06 33.21 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 118.189 0.45 . . . . 0.0 112.171 179.447 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.501 ' HG2' ' HA ' ' A' ' 94' ' ' ASP . 16.5 ptpt -75.32 -28.66 59.74 Favored 'General case' 0 N--CA 1.485 1.296 0 CA-C-O 120.882 0.373 . . . . 0.0 110.077 -177.514 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -91.37 -41.37 10.94 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.721 0.809 . . . . 0.0 111.296 178.736 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 3.8 t -132.54 76.04 72.49 Favored Pre-proline 0 CA--C 1.56 1.357 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 -175.516 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -74.02 0.9 7.77 Favored 'Trans proline' 0 C--N 1.373 1.84 0 C-N-CA 122.579 2.186 . . . . 0.0 114.123 -174.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 22.8 p90 -108.18 -8.61 15.72 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.445 0.698 . . . . 0.0 112.599 -176.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.409 HG21 ' HG3' ' A' ' 95' ' ' ARG . 14.7 t -65.62 123.18 83.91 Favored Pre-proline 0 CA--C 1.566 1.578 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -170.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -76.47 -19.23 15.05 Favored 'Trans proline' 0 C--N 1.377 2.05 0 C-N-CA 122.482 2.121 . . . . 0.0 112.041 171.255 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.401 ' HB3' ' HB2' ' A' ' 108' ' ' CYS . 6.9 m-85 -113.02 162.93 15.32 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.848 0.859 . . . . 0.0 109.766 -176.191 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 31.1 p -92.32 168.38 11.35 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 175.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -55.13 -32.46 62.09 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.618 0.767 . . . . 0.0 111.905 -178.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -67.74 -45.29 75.4 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.757 0.823 . . . . 0.0 109.917 178.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.401 ' HB2' ' HB3' ' A' ' 104' ' ' PHE . 91.6 m -69.65 -30.61 68.34 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.411 177.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.0 -32.4 74.1 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.419 0.688 . . . . 0.0 110.772 173.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -80.79 -21.16 41.2 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.588 0.755 . . . . 0.0 111.3 173.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -105.06 21.38 17.2 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.745 0.818 . . . . 0.0 112.47 -178.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 90.3 mt . . . . . 0 N--CA 1.484 1.261 0 C-N-CA 123.28 0.632 . . . . 0.0 109.997 175.324 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 6.6 mp . . . . . 0 N--CA 1.481 1.091 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -86.66 128.5 35.01 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.173 0.589 . . . . 0.0 109.886 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -170.98 169.16 42.25 Favored Glycine 0 C--N 1.346 1.1 0 O-C-N 123.071 0.232 . . . . 0.0 112.832 178.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 79.32 27.47 55.22 Favored Glycine 0 C--N 1.345 1.063 0 CA-C-O 119.718 -0.49 . . . . 0.0 114.09 175.144 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -75.67 -56.56 4.57 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 117.539 0.669 . . . . 0.0 109.341 172.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 26.7 m -102.98 -60.59 1.52 Allowed 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 168.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 89.5 mtp -148.18 -53.81 0.2 Allowed 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.701 1.2 . . . . 0.0 108.257 174.409 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 16.4 m120 59.77 77.09 0.33 Allowed 'General case' 0 C--N 1.352 0.712 0 C-N-CA 124.788 1.235 . . . . 0.0 109.054 -168.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 44.3 t -65.24 -26.04 38.71 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-N 114.35 -1.295 . . . . 0.0 111.795 -170.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -61.87 -31.02 71.26 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.351 0.66 . . . . 0.0 112.572 179.353 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.4 m -66.96 -40.24 87.44 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 121.395 0.617 . . . . 0.0 109.869 172.528 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -72.64 -30.24 64.14 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.749 178.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.529 ' HG2' HD13 ' A' ' 76' ' ' ILE . 41.2 mt-10 -66.49 -52.44 45.97 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 122.95 0.5 . . . . 0.0 110.385 -179.254 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -65.39 -41.56 93.58 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 123.938 0.774 . . . . 0.0 111.687 -176.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 12.0 tt -65.0 -34.82 73.2 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 CA-C-O 120.727 0.298 . . . . 0.0 110.281 -178.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.5 mt -69.24 -38.26 78.4 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 122.77 0.428 . . . . 0.0 111.119 176.161 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -58.83 -50.41 74.09 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.005 0.522 . . . . 0.0 110.268 175.276 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -61.35 -47.9 83.76 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.451 0.7 . . . . 0.0 111.669 -179.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.77 -40.69 98.08 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.452 0.701 . . . . 0.0 111.404 -178.203 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.666 ' HB3' HG21 ' A' ' 69' ' ' ILE . 3.0 pt20 -76.05 -32.34 59.26 Favored 'General case' 0 C--O 1.214 -0.815 0 CA-C-O 119.045 -0.502 . . . . 0.0 111.432 -177.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.0 mmt180 -76.24 -36.01 58.71 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 117.97 0.35 . . . . 0.0 111.365 -176.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -67.93 -41.19 82.96 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 174.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.51 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 75.6 mt -65.5 -43.02 91.47 Favored 'General case' 0 C--N 1.354 0.78 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.391 174.39 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -58.36 -54.0 51.98 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.862 0.865 . . . . 0.0 110.702 -175.561 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.9 ptt180 -69.11 -27.61 65.73 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 123.742 0.651 . . . . 0.0 111.224 -178.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 44.0 ttt85 -66.23 -58.32 5.65 Favored 'General case' 0 C--N 1.362 1.11 0 C-N-CA 122.919 0.488 . . . . 0.0 111.269 176.363 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.638 HD21 HD22 ' A' ' 66' ' ' LEU . 4.0 pp -72.76 -26.52 61.58 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 122.86 0.464 . . . . 0.0 111.022 -175.611 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 42.9 m-70 -84.8 31.75 0.53 Allowed 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.095 0.558 . . . . 0.0 111.376 173.012 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 17.9 pttp -57.45 -18.2 17.15 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 124.414 1.086 . . . . 0.0 113.646 175.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.528 ' H ' HD13 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -64.33 -43.67 97.16 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 CA-C-O 118.907 -0.568 . . . . 0.0 112.294 177.653 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -119.12 -22.9 7.01 Favored 'General case' 0 N--CA 1.499 2.003 0 CA-C-N 119.185 0.902 . . . . 0.0 112.385 -179.473 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -84.55 138.46 32.74 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 122.73 0.412 . . . . 0.0 110.295 -177.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -125.81 155.95 40.31 Favored 'General case' 0 C--O 1.241 0.658 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.7 174.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -127.74 45.75 2.68 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 167.466 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -63.59 -44.18 94.79 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 114.863 -1.062 . . . . 0.0 109.668 178.106 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -92.78 130.91 35.05 Favored Pre-proline 0 CA--C 1.551 0.985 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.659 173.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -65.35 94.1 0.24 Allowed 'Trans proline' 0 C--N 1.376 1.986 0 C-N-CA 123.307 2.671 . . . . 0.0 112.247 174.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.8 mmm180 -89.36 148.48 23.49 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 173.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.593 ' HB2' ' HB2' ' A' ' 42' ' ' ASP . 62.7 m-20 -73.74 160.01 83.05 Favored Pre-proline 0 CA--C 1.56 1.346 0 C-N-CA 123.169 0.588 . . . . 0.0 110.102 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -54.09 -49.37 17.28 Favored 'Trans proline' 0 C--N 1.383 2.37 0 C-N-CA 123.009 2.473 . . . . 0.0 113.179 -178.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -103.42 18.31 22.1 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 115.0 -1.0 . . . . 0.0 111.278 -178.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.593 ' HB2' ' HB2' ' A' ' 39' ' ' ASN . 22.0 t70 -60.08 -33.0 71.48 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 123.658 0.783 . . . . 0.0 110.834 178.627 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -56.44 -26.31 53.26 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.138 0.975 . . . . 0.0 111.843 175.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 25.2 t70 66.41 -80.6 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.086 1.355 . . . . 0.0 109.831 -179.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 18.5 ttm180 -149.24 51.87 0.96 Allowed 'General case' 0 C--O 1.238 0.497 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 174.237 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.64 127.79 33.79 Favored 'General case' 0 C--O 1.246 0.897 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.182 178.156 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.8 p -53.93 110.66 0.62 Allowed 'General case' 0 CA--C 1.548 0.874 0 O-C-N 124.261 0.975 . . . . 0.0 110.39 -178.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -72.19 98.03 2.07 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.57 0.748 . . . . 0.0 109.218 -173.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -62.53 112.25 2.39 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 114.48 -1.236 . . . . 0.0 112.091 -167.008 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.2 m -72.08 122.33 20.76 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.248 1.019 . . . . 0.0 110.702 -176.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -113.28 109.74 19.23 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 175.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -73.32 -23.15 60.22 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.113 0.965 . . . . 0.0 111.641 -175.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -93.57 148.78 21.78 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.546 0.739 . . . . 0.0 109.928 178.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 59.4 t -68.52 -49.44 65.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 O-C-N 123.758 0.661 . . . . 0.0 109.654 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 40.6 tp 65.49 109.7 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 124.868 1.267 . . . . 0.0 111.632 178.176 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -67.41 -19.56 65.41 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.117 0.967 . . . . 0.0 111.735 -177.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -74.56 -8.26 55.78 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.357 0.663 . . . . 0.0 112.55 -177.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.447 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 59.8 mt -77.73 -73.36 0.31 Allowed 'General case' 0 CA--C 1.546 0.82 0 O-C-N 123.087 0.242 . . . . 0.0 110.597 178.355 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 129.7 124.7 2.65 Favored Glycine 0 N--CA 1.474 1.227 0 N-CA-C 111.375 -0.69 . . . . 0.0 111.375 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -66.05 -38.19 87.73 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -164.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 6.1 p -62.36 -39.4 84.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 CA-C-N 118.399 0.545 . . . . 0.0 110.692 177.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.481 ' O ' ' HB2' ' A' ' 66' ' ' LEU . . . -66.39 -49.89 53.66 Favored Glycine 0 C--N 1.344 0.98 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.632 176.463 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -67.23 -35.72 80.14 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 124.593 1.157 . . . . 0.0 112.24 -174.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -73.11 -48.69 33.52 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.577 -176.063 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -64.96 -34.57 78.73 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 115.013 -0.994 . . . . 0.0 109.74 177.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.638 HD22 HD21 ' A' ' 27' ' ' LEU . 13.9 tp -60.84 -46.02 92.23 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.691 1.197 . . . . 0.0 109.911 175.517 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 51.7 ttt180 -61.92 -38.09 87.12 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.172 0.989 . . . . 0.0 110.93 -178.469 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.16 -43.26 99.17 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 123.81 0.694 . . . . 0.0 110.253 176.093 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.666 HG21 ' HB3' ' A' ' 20' ' ' GLN . 85.1 mt -65.2 -45.49 93.69 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.871 179.076 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -66.14 -33.09 74.98 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.912 0.885 . . . . 0.0 111.123 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.58 -35.89 73.28 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.093 0.957 . . . . 0.0 110.243 177.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.431 ' O ' HG13 ' A' ' 76' ' ' ILE . . . -68.44 -47.28 67.59 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.64 177.348 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.505 HD23 HD12 ' A' ' 76' ' ' ILE . 88.2 mt -63.24 -33.76 76.19 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 124.192 0.997 . . . . 0.0 111.491 177.115 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.0 -41.24 95.57 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.667 0.787 . . . . 0.0 110.355 175.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 89.1 mtm180 -68.82 -30.43 68.97 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.382 0.673 . . . . 0.0 111.604 176.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.529 HD13 ' HG2' ' A' ' 13' ' ' GLU . 75.1 mt -68.99 -42.63 82.22 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 176.499 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.53 -34.25 77.81 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.767 176.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.8 t -82.0 -12.79 58.14 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 124.035 0.934 . . . . 0.0 111.114 178.268 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 75.71 9.64 84.88 Favored Glycine 0 C--N 1.353 1.521 0 C-N-CA 123.086 0.375 . . . . 0.0 113.627 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 15.2 t -112.42 28.18 9.0 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.24 1.016 . . . . 0.0 109.774 -177.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -66.45 144.41 56.51 Favored 'General case' 0 C--N 1.348 0.527 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.901 172.291 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.585 ' HA2' HD21 ' A' ' 96' ' ' LEU . . . 77.87 37.27 30.12 Favored Glycine 0 C--N 1.34 0.77 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.769 -172.256 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 93.9 m -123.79 118.26 26.77 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.557 0.743 . . . . 0.0 110.586 177.181 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 48.8 t -62.02 92.85 0.04 OUTLIER 'General case' 0 C--N 1.352 0.699 0 C-N-CA 124.927 1.291 . . . . 0.0 108.239 166.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 33.1 m -62.88 -27.33 42.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 124.003 0.921 . . . . 0.0 112.25 -173.211 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.676 ' HE3' ' HA ' ' A' ' 112' ' ' LEU . 59.4 tttm -70.48 -20.63 62.85 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.25 1.02 . . . . 0.0 111.573 178.681 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 11.8 m -120.48 -13.54 8.79 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 123.959 0.903 . . . . 0.0 111.342 -174.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 60.83 31.6 76.42 Favored Glycine 0 C--N 1.353 1.473 0 CA-C-N 116.48 -0.327 . . . . 0.0 113.266 -173.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -135.74 -174.49 3.67 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.761 0.824 . . . . 0.0 110.691 -176.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.471 ' HD3' ' O ' ' A' ' 82' ' ' GLY . 4.3 tpp180 -74.7 151.93 39.17 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.854 0.862 . . . . 0.0 112.918 -169.885 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 23.9 mm -95.48 148.85 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 124.345 1.058 . . . . 0.0 108.513 167.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.4 m -71.75 145.46 48.74 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.643 0.777 . . . . 0.0 110.05 177.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -58.32 -41.03 83.65 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.245 0.618 . . . . 0.0 110.929 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -62.55 -38.97 92.11 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.324 1.05 . . . . 0.0 111.101 179.318 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.447 ' HE ' HG21 ' A' ' 102' ' ' THR . 25.5 tpt180 -69.66 -33.46 72.62 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.74 178.604 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.585 HD21 ' HA2' ' A' ' 82' ' ' GLY . 87.0 mt -73.17 -45.23 57.77 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 122.817 0.447 . . . . 0.0 111.421 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -71.32 -28.46 64.11 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 122.808 0.443 . . . . 0.0 110.938 -175.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -88.34 -47.16 8.6 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.336 0.654 . . . . 0.0 111.058 178.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 1.7 t -129.87 79.66 72.81 Favored Pre-proline 0 CA--C 1.559 1.308 0 C-N-CA 124.029 0.931 . . . . 0.0 108.639 -175.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -73.37 -8.17 21.45 Favored 'Trans proline' 0 C--N 1.372 1.774 0 C-N-CA 122.285 1.99 . . . . 0.0 113.445 -177.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 26.6 p90 -100.86 -8.69 22.35 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -176.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.447 HG21 ' HE ' ' A' ' 95' ' ' ARG . 13.8 t -62.06 122.17 70.57 Favored Pre-proline 0 CA--C 1.563 1.443 0 O-C-N 123.129 0.268 . . . . 0.0 111.365 -172.152 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -66.44 -37.85 21.75 Favored 'Trans proline' 0 C--N 1.376 2.026 0 C-N-CA 122.461 2.107 . . . . 0.0 111.371 173.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -99.57 -179.49 4.22 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.694 -178.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.732 ' SG ' ' HB2' ' A' ' 108' ' ' CYS . 15.0 p -98.71 179.64 4.6 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 124.875 1.27 . . . . 0.0 109.227 173.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -64.86 -55.51 19.04 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 118.051 0.387 . . . . 0.0 111.459 -177.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.06 -34.25 76.08 Favored 'General case' 0 N--CA 1.483 1.225 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -175.068 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.732 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 68.3 m -81.04 -22.95 38.91 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 179.433 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -78.74 -24.23 44.94 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 171.439 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -81.87 -27.4 33.5 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.605 0.762 . . . . 0.0 110.797 172.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -131.51 78.19 1.81 Allowed 'General case' 0 C--O 1.242 0.677 0 C-N-CA 124.137 0.975 . . . . 0.0 109.959 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.676 ' HA ' ' HE3' ' A' ' 86' ' ' LYS . 73.7 mt . . . . . 0 CA--C 1.551 1.017 0 CA-C-N 114.677 -1.147 . . . . 0.0 109.89 175.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_