data_2l6o_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 2l6o _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 ' 6' ' ' THR . . . . . . . . . . . . . 44.1 p . . . . . 0 CA--C 1.537 0.449 0 N-CA-C 111.574 0.213 . . . . 0.0 111.574 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -74.11 -55.1 0.09 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.113 0 C-N-CA 120.682 0.921 . . . . 0.0 110.761 -174.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -156.09 144.58 14.58 Favored Pre-proline 0 C--O 1.237 0.414 0 N-CA-C 106.091 -1.818 . . . . 0.0 106.091 -179.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -69.57 -29.52 24.66 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.053 1.835 . . . . 0.0 110.78 174.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -82.38 -15.53 52.39 Favored 'General case' 0 N--CA 1.455 -0.2 0 O-C-N 121.916 -0.49 . . . . 0.0 112.277 -171.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.6 tt -63.0 122.46 16.1 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 170.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 21.0 mm -103.09 109.25 26.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 N-CA-C 107.167 -1.42 . . . . 0.0 107.167 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 85.6 m95 -58.81 156.35 25.52 Favored Pre-proline 0 CA--C 1.542 0.644 0 C-N-CA 124.134 0.974 . . . . 0.0 111.079 179.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -66.92 170.26 45.43 Favored 'Cis proline' 0 N--CA 1.458 -0.604 0 C-N-CA 125.303 -0.707 . . . . 0.0 113.38 -4.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -136.5 168.75 18.88 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.591 0.71 . . . . 0.0 110.678 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 18.9 mt -136.01 103.57 5.4 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 125.826 1.651 . . . . 0.0 108.027 -174.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.5 tp -87.35 143.44 27.25 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 174.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.11 83.31 1.97 Allowed 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 119.992 1.269 . . . . 0.0 110.373 179.092 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -59.7 155.27 16.15 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 123.439 0.695 . . . . 0.0 111.714 -161.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.13 139.92 58.74 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-O 123.317 1.532 . . . . 0.0 108.694 -176.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 69.12 -33.65 0.31 Allowed Glycine 0 CA--C 1.533 1.177 0 C-N-CA 127.487 2.47 . . . . 0.0 113.805 -175.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 89.8 m -76.18 176.31 8.17 Favored 'General case' 0 C--O 1.24 0.59 0 CA-C-N 120.755 2.277 . . . . 0.0 111.03 177.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.5 m-80 -128.46 -22.52 3.34 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 124.858 1.263 . . . . 0.0 111.465 -176.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -66.37 111.08 3.34 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 107.929 -1.138 . . . . 0.0 107.929 -176.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.476 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 3.2 mm? -60.09 139.14 57.67 Favored 'General case' 0 CA--C 1.512 -0.506 0 N-CA-C 107.208 -1.405 . . . . 0.0 107.208 167.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -103.85 87.46 1.53 Allowed Pre-proline 0 C--N 1.324 -0.506 0 N-CA-C 104.579 -2.378 . . . . 0.0 104.579 176.567 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -62.54 140.95 84.42 Favored 'Trans proline' 0 N--CA 1.452 -0.956 0 N-CA-C 108.147 -1.521 . . . . 0.0 108.147 170.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.8 mt -138.5 100.29 4.06 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 104.614 -2.365 . . . . 0.0 104.614 -177.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 63.8 mtt180 -59.09 -35.93 74.24 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 118.352 0.524 . . . . 0.0 111.206 -175.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 15.0 t -161.66 -178.93 6.88 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 123.628 0.771 . . . . 0.0 109.018 -175.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -57.84 -28.36 64.03 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 125.497 1.519 . . . . 0.0 112.587 -179.33 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -61.52 -41.16 96.92 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.702 -0.624 . . . . 0.0 109.981 176.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -66.34 -30.84 71.32 Favored 'General case' 0 CA--C 1.522 -0.117 0 C-N-CA 123.783 0.833 . . . . 0.0 110.925 -175.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 63.5 t-105 -74.48 -43.09 57.64 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.671 0.788 . . . . 0.0 111.061 173.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -63.3 -35.44 80.38 Favored 'General case' 0 CA--C 1.528 0.13 0 O-C-N 121.698 -0.627 . . . . 0.0 110.283 176.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 63.2 mtt180 . . . . . 0 CA--C 1.538 0.495 0 C-N-CA 124.511 1.124 . . . . 0.0 112.357 173.204 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.8 mt . . . . . 0 CA--C 1.511 -0.529 0 CA-C-O 122.823 1.297 . . . . 0.0 109.826 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -88.63 152.0 22.11 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 113.779 -1.555 . . . . 0.0 109.577 -175.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.421 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 1.4 m-85 -71.54 93.27 1.19 Allowed 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 173.584 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 141.85 -5.27 2.24 Favored Glycine 0 N--CA 1.443 -0.891 0 CA-C-O 117.824 -1.542 . . . . 0.0 113.816 -163.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.55 -7.49 44.25 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 116.684 2.105 . . . . 0.0 116.684 -164.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.0 tppt? 44.65 130.89 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 131.405 3.882 . . . . 0.0 116.213 -174.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.1 mt -117.52 152.52 34.92 Favored 'General case' 0 C--N 1.331 -0.238 0 O-C-N 120.776 -1.202 . . . . 0.0 107.995 164.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 54.1 t -133.82 141.49 43.92 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 105.817 -1.919 . . . . 0.0 105.817 167.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -109.49 174.84 5.68 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 125.489 1.516 . . . . 0.0 110.448 175.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.2 m -60.89 -17.11 48.69 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -179.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -98.03 11.08 38.75 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.836 1.254 . . . . 0.0 111.308 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 64.54 24.75 13.12 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.023 1.729 . . . . 0.0 111.987 176.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 32.8 m80 -75.65 114.97 14.83 Favored 'General case' 0 C--N 1.332 -0.186 0 O-C-N 120.43 -1.418 . . . . 0.0 107.711 166.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.3 m -73.1 153.86 40.63 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 122.129 0.966 . . . . 0.0 108.949 161.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -140.33 157.54 45.39 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 126.359 1.864 . . . . 0.0 106.846 171.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 79.0 t -129.0 148.79 33.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 106.155 -1.794 . . . . 0.0 106.155 167.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 18.3 tp -86.93 144.14 27.08 Favored 'General case' 0 CA--C 1.521 -0.163 0 C-N-CA 125.925 1.69 . . . . 0.0 109.137 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -116.03 165.19 13.4 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 124.402 1.081 . . . . 0.0 110.359 -175.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.421 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 0.1 OUTLIER -68.18 -14.49 63.02 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 173.798 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -81.02 16.14 1.6 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.581 1.553 . . . . 0.0 111.823 173.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 45.78 37.36 3.38 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 126.854 2.062 . . . . 0.0 112.411 -178.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.1 p-80 -125.6 170.28 11.64 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 172.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 62.4 m95 -111.71 127.57 55.82 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 107.203 -1.406 . . . . 0.0 107.203 175.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -97.76 145.79 30.34 Favored Pre-proline 0 CA--C 1.537 0.481 0 C-N-CA 123.975 0.91 . . . . 0.0 108.966 178.201 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.26 116.01 4.52 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 123.376 2.717 . . . . 0.0 110.881 175.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -117.87 57.37 0.83 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.863 1.665 . . . . 0.0 109.568 -170.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.11 156.24 0.14 Allowed Pre-proline 0 CA--C 1.538 0.497 0 C-N-CA 129.731 3.213 . . . . 0.0 114.147 178.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -72.07 169.85 20.4 Favored 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 121.765 1.643 . . . . 0.0 110.355 161.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 11.3 tp -126.21 144.66 49.82 Favored Pre-proline 0 N--CA 1.451 -0.42 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.922 -167.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -69.95 165.28 31.72 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 121.614 1.542 . . . . 0.0 111.52 176.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -56.47 -31.11 84.79 Favored 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 123.434 2.756 . . . . 0.0 113.388 174.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -81.72 -15.96 52.7 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.278 1.031 . . . . 0.0 112.242 176.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -76.75 -22.15 72.83 Favored Glycine 0 CA--C 1.527 0.794 0 O-C-N 121.763 -0.586 . . . . 0.0 112.104 -174.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 29.7 tp -63.49 -48.53 77.24 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 121.694 -0.886 . . . . 0.0 109.6 164.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -53.86 -37.77 64.0 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 118.695 -0.669 . . . . 0.0 111.479 175.266 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -60.4 -34.38 73.84 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.564 1.075 . . . . 0.0 113.053 177.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.9 mp -67.8 -64.07 0.93 Allowed 'General case' 0 N--CA 1.456 -0.127 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 172.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.9 mm -60.58 -26.96 39.31 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 C-N-CA 123.681 0.792 . . . . 0.0 111.538 -170.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -44.98 -41.62 7.5 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 125.415 1.486 . . . . 0.0 110.905 168.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.56 -63.58 1.09 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.771 1.228 . . . . 0.0 111.522 176.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.476 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 7.4 t60 -55.77 -40.1 72.15 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.368 1.067 . . . . 0.0 111.267 -177.222 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 23.7 m -68.46 -51.81 39.5 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 120.38 -1.45 . . . . 0.0 110.301 177.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.74 -33.24 75.42 Favored 'General case' 0 C--N 1.339 0.137 0 CA-C-N 119.099 0.863 . . . . 0.0 111.887 -175.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.3 t -71.13 -28.41 64.27 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 118.403 -0.808 . . . . 0.0 109.302 -176.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 98.1 mt -88.4 -56.68 3.21 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 124.478 1.111 . . . . 0.0 110.858 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 142.99 9.45 0.51 Allowed Glycine 0 CA--C 1.532 1.118 0 CA-C-O 117.96 -1.467 . . . . 0.0 114.38 -172.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 7.3 m-70 . . . . . 0 N--CA 1.464 0.225 0 CA-C-N 120.456 2.128 . . . . 0.0 111.877 -173.562 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.329 0 CA-C-O 118.901 -0.571 . . . . 0.0 110.276 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 77.7 mt -147.4 134.71 20.64 Favored 'General case' 0 CA--C 1.512 -0.499 0 C-N-CA 124.947 1.299 . . . . 0.0 107.664 -174.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 51.9 t-80 -61.92 -48.08 82.05 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 122.04 0.924 . . . . 0.0 110.536 178.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 2.8 m -164.82 -178.17 5.11 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.767 1.227 . . . . 0.0 111.296 -169.07 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 63.2 t -64.54 -38.24 82.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 CA-C-O 118.47 -0.776 . . . . 0.0 110.659 -176.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.01 -50.44 61.37 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 119.257 0.935 . . . . 0.0 109.122 177.002 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -65.53 -36.29 83.36 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.858 1.263 . . . . 0.0 110.307 -175.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.3 -48.5 81.09 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.999 0.519 . . . . 0.0 110.48 176.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 20.2 mm -65.24 -28.35 44.34 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 -178.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -69.8 -48.4 59.27 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.198 -0.939 . . . . 0.0 109.415 173.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -57.79 -65.11 0.69 Allowed 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 125.781 1.632 . . . . 0.0 111.629 -179.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.4 mp -49.23 -33.95 13.83 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 126.237 1.815 . . . . 0.0 113.914 -175.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -62.18 -44.99 95.38 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 118.141 0.428 . . . . 0.0 112.049 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -82.52 -8.68 59.61 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -173.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . 0.275 3.2 tp . . . . . 0 N--CA 1.4 -2.948 0 C-N-CA 128.352 2.661 . . . . 0.0 107.51 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 20.6 p . . . . . 0 CA--C 1.535 0.386 0 CA-C-O 118.773 -0.632 . . . . 0.0 110.775 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.98 -55.48 0.31 Allowed 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 120.928 1.086 . . . . 0.0 111.697 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -160.82 143.78 9.69 Favored Pre-proline 0 CA--C 1.534 0.362 0 CA-C-N 119.485 1.039 . . . . 0.0 110.29 -173.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -73.84 -23.49 16.43 Favored 'Trans proline' 0 CA--C 1.531 0.372 0 C-N-CA 121.446 1.431 . . . . 0.0 113.56 -176.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 -72.25 -28.74 63.34 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-O 116.899 -1.524 . . . . 0.0 111.974 172.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.5 tt -56.33 123.59 15.14 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 120.106 1.321 . . . . 0.0 110.939 -173.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 28.0 mm -106.25 97.19 5.31 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.145 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 -177.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.428 ' CH2' ' HB2' ' A' ' 34' ' ' TRP . 81.5 m95 -51.16 144.06 15.63 Favored Pre-proline 0 C--O 1.236 0.391 0 O-C-N 123.761 0.663 . . . . 0.0 111.057 174.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -75.87 169.71 73.77 Favored 'Cis proline' 0 N--CA 1.458 -0.58 0 N-CA-C 114.142 0.785 . . . . 0.0 114.142 8.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -138.02 171.33 14.57 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 121.282 0.563 . . . . 0.0 111.496 175.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 19.3 mt -137.58 109.17 6.99 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 125.966 1.706 . . . . 0.0 108.067 -173.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 13.4 tp -94.41 137.79 33.13 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.549 1.139 . . . . 0.0 108.678 175.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -130.88 84.89 2.22 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.678 1.126 . . . . 0.0 110.959 179.342 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -46.21 132.43 9.88 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 126.982 2.113 . . . . 0.0 110.004 -175.237 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -60.71 127.68 32.84 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 122.601 1.191 . . . . 0.0 110.117 177.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 99.06 -49.53 1.23 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 126.295 1.902 . . . . 0.0 110.106 -174.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 57.1 m -67.99 169.26 10.32 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 122.831 1.3 . . . . 0.0 111.11 -178.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -129.41 -30.59 2.12 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 125.346 1.459 . . . . 0.0 108.935 -178.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -72.83 98.62 2.47 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 126.538 1.935 . . . . 0.0 108.579 -172.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.463 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 2.0 mm? -53.87 152.29 5.71 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 123.638 0.775 . . . . 0.0 110.918 -173.365 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -105.54 86.61 1.82 Allowed Pre-proline 0 C--O 1.235 0.306 0 C-N-CA 124.907 1.283 . . . . 0.0 108.197 172.26 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -66.94 142.74 63.51 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 121.832 1.688 . . . . 0.0 109.139 168.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.7 mt -145.86 109.32 4.71 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 -179.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.8 mmt85 -60.04 -47.7 84.75 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 123.644 0.777 . . . . 0.0 110.571 -176.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 45.3 p -139.86 174.64 10.31 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 124.135 0.974 . . . . 0.0 109.306 -172.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.75 -20.87 66.09 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.96 0.504 . . . . 0.0 111.486 173.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 48.1 m-20 -55.52 -42.5 74.62 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 123.794 0.838 . . . . 0.0 108.766 171.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -81.75 -29.64 32.77 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 123.14 0.576 . . . . 0.0 111.672 -173.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.428 ' HB2' ' CH2' ' A' ' 13' ' ' TRP . 44.7 t-105 -56.88 -45.49 82.49 Favored 'General case' 0 CA--C 1.528 0.129 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 169.537 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 66.2 mm-40 -64.33 -47.65 78.56 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 123.047 0.539 . . . . 0.0 110.367 174.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 28.1 mtt180 . . . . . 0 N--CA 1.475 0.806 0 CA-C-O 118.164 -0.922 . . . . 0.0 113.43 178.166 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 85.2 mt . . . . . 0 N--CA 1.451 -0.382 0 N-CA-C 105.244 -2.132 . . . . 0.0 105.244 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -117.12 152.0 35.65 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 125.469 1.508 . . . . 0.0 108.731 -177.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.416 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 11.7 m-85 -58.06 138.27 56.17 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 107.092 -1.448 . . . . 0.0 107.092 167.311 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.75 3.18 80.79 Favored Glycine 0 CA--C 1.529 0.962 0 CA-C-O 117.55 -1.694 . . . . 0.0 114.872 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -65.97 -10.66 41.37 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 120.231 2.016 . . . . 0.0 115.154 -170.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 53.68 127.92 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 129.67 3.188 . . . . 0.0 115.443 176.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 13.0 mt -113.21 157.24 21.98 Favored 'General case' 0 C--N 1.328 -0.363 0 O-C-N 121.007 -1.058 . . . . 0.0 108.45 165.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 47.7 t -146.05 138.32 20.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 C-N-CA 128.379 2.672 . . . . 0.0 104.146 177.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.8 p-10 -118.15 -179.1 3.67 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 124.725 1.21 . . . . 0.0 111.347 177.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.64 -7.7 16.54 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 177.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -100.75 5.29 43.57 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.787 1.635 . . . . 0.0 111.54 174.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 59.06 20.27 8.13 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.343 1.457 . . . . 0.0 111.402 -178.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 49.5 m170 -72.35 111.77 7.83 Favored 'General case' 0 C--O 1.233 0.232 0 O-C-N 120.283 -1.511 . . . . 0.0 107.789 171.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -78.65 147.78 33.45 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 175.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -142.64 143.65 32.45 Favored 'General case' 0 N--CA 1.435 -1.222 0 CA-C-N 113.114 -1.857 . . . . 0.0 107.248 -172.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 55.5 t -127.94 146.99 32.66 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 C-N-CA 128.519 2.728 . . . . 0.0 107.128 177.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 22.2 tp -87.96 138.76 31.17 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 124.926 1.291 . . . . 0.0 107.618 171.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -117.23 169.04 9.78 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 123.666 0.786 . . . . 0.0 111.39 176.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.416 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 20.6 mp0 -57.94 -24.67 58.95 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.359 1.464 . . . . 0.0 112.55 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -71.57 -0.51 10.81 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.508 1.123 . . . . 0.0 113.386 178.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 66.02 12.16 8.26 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 128.395 2.678 . . . . 0.0 113.883 -178.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.416 ' CD2' ' HD1' ' A' ' 68' ' ' HIS . 1.3 p-80 -99.56 179.95 4.39 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 124.36 1.064 . . . . 0.0 110.517 168.779 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 76.6 m95 -117.47 121.55 41.33 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.49 1.516 . . . . 0.0 107.02 175.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.416 ' HD1' ' CD2' ' A' ' 66' ' ' HIS . 0.2 OUTLIER -110.78 147.71 37.03 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 125.215 1.406 . . . . 0.0 111.804 179.208 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -67.16 145.72 73.83 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.903 2.402 . . . . 0.0 112.73 -170.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -138.04 43.78 2.2 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.48 1.112 . . . . 0.0 110.852 -172.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.52 164.6 0.13 Allowed Pre-proline 0 N--CA 1.47 0.575 0 C-N-CA 128.355 2.662 . . . . 0.0 113.779 175.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -69.73 168.64 20.93 Favored 'Trans proline' 0 N--CA 1.452 -0.961 0 C-N-CA 121.343 1.362 . . . . 0.0 111.367 167.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.3 tt -123.56 143.2 40.96 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 125.105 1.362 . . . . 0.0 108.51 -172.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -79.41 163.81 24.36 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.327 2.684 . . . . 0.0 112.178 -173.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.3 -7.88 17.09 Favored 'Trans proline' 0 CA--C 1.53 0.295 0 C-N-CA 123.119 2.546 . . . . 0.0 114.741 -178.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -106.71 -16.6 14.45 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.968 1.707 . . . . 0.0 112.398 173.439 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -67.03 -29.22 74.29 Favored Glycine 0 CA--C 1.531 1.07 0 CA-C-N 119.886 1.221 . . . . 0.0 112.281 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 30.7 tp -65.32 -50.58 65.12 Favored 'General case' 0 C--N 1.34 0.16 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -60.94 -30.57 70.3 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 125.57 1.548 . . . . 0.0 110.034 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -65.99 -47.93 72.89 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 119.281 0.946 . . . . 0.0 110.106 174.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 23.2 mt -64.61 -51.13 64.25 Favored 'General case' 0 CA--C 1.52 -0.177 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 -179.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 14.8 mm -58.77 -31.85 45.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 C-N-CA 123.633 0.773 . . . . 0.0 110.899 179.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -51.88 -38.91 57.95 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 119.914 1.233 . . . . 0.0 111.702 174.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.26 -57.65 10.38 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 118.811 0.732 . . . . 0.0 111.003 176.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.463 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 21.5 t60 -55.42 -46.72 76.66 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.323 1.049 . . . . 0.0 110.038 176.662 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 73.3 m -72.7 -24.22 60.97 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 120.589 -1.319 . . . . 0.0 112.917 -174.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -97.3 -8.94 28.55 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.512 1.125 . . . . 0.0 112.902 -177.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.5 t -89.71 -20.98 22.95 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 167.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 63.8 mt -115.63 -21.61 9.61 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -176.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 101.22 19.74 15.71 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 115.679 1.031 . . . . 0.0 115.679 172.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 10.4 m-70 . . . . . 0 CA--C 1.533 0.326 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 -158.99 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.535 0.367 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 81.1 mt -141.27 142.74 33.88 Favored 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -168.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 1.4 m170 -75.64 -36.37 60.22 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 125.038 1.461 . . . . 0.0 110.357 -174.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.6 p -164.2 -173.93 3.33 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.963 1.305 . . . . 0.0 109.977 169.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 87.7 t -60.8 -41.41 88.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 C-N-CA 124.783 1.233 . . . . 0.0 111.059 176.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.9 -46.01 78.48 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 119.677 1.126 . . . . 0.0 110.032 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -66.01 -34.26 77.69 Favored 'General case' 0 C--O 1.227 -0.098 0 C-N-CA 123.138 0.575 . . . . 0.0 110.651 178.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -55.99 -53.04 61.77 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 123.244 0.618 . . . . 0.0 110.551 175.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 30.9 mm -60.86 -34.07 57.95 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 C-N-CA 123.275 0.63 . . . . 0.0 109.805 -176.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -81.15 -27.35 35.49 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.948 0.722 . . . . 0.0 112.948 178.419 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -67.33 -65.43 0.69 Allowed 'General case' 0 C--O 1.224 -0.255 0 C-N-CA 125.299 1.44 . . . . 0.0 107.976 172.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.9 mp -49.88 -46.18 51.35 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.359 1.464 . . . . 0.0 112.019 -176.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -69.52 -19.94 63.71 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 119.171 0.896 . . . . 0.0 113.166 -179.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -93.41 -19.34 21.39 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 123.814 0.846 . . . . 0.0 111.541 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 42.1 mt . . . . . 0 N--CA 1.452 -0.362 0 C-N-CA 124.404 1.082 . . . . 0.0 109.771 177.383 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 35.6 p . . . . . 0 C--O 1.242 0.688 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -77.77 76.21 4.41 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 122.569 2.179 . . . . 0.0 110.014 -177.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 75.22 144.63 0.11 Allowed Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 128.052 2.541 . . . . 0.0 112.048 -178.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -82.79 -25.96 2.69 Favored 'Trans proline' 0 CA--C 1.538 0.682 0 C-N-CA 122.743 2.296 . . . . 0.0 112.836 174.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -74.67 -18.06 60.59 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 121.226 -0.921 . . . . 0.0 111.891 176.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.7 tt -61.84 115.22 3.84 Favored 'General case' 0 C--N 1.34 0.18 0 N-CA-C 107.175 -1.417 . . . . 0.0 107.175 167.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 23.7 mm -98.3 116.05 40.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 N-CA-C 106.71 -1.589 . . . . 0.0 106.71 174.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -62.44 154.18 73.46 Favored Pre-proline 0 C--O 1.239 0.551 0 CA-C-O 119.558 -0.258 . . . . 0.0 110.347 175.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -66.92 166.59 61.24 Favored 'Cis proline' 0 N--CA 1.458 -0.602 0 N-CA-C 114.615 0.967 . . . . 0.0 114.615 -0.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -131.87 168.09 18.45 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 123.438 0.695 . . . . 0.0 110.732 176.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 12.3 mt -138.93 94.79 2.86 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 126.084 1.754 . . . . 0.0 108.209 -175.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.2 tp -74.59 142.12 44.67 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 171.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.43 97.18 3.0 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 174.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -56.69 154.59 8.73 Favored 'General case' 0 N--CA 1.444 -0.734 0 O-C-N 124.436 1.085 . . . . 0.0 112.189 -169.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -68.53 124.77 24.5 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 114.672 -1.149 . . . . 0.0 108.61 174.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 99.02 -46.84 1.42 Allowed Glycine 0 CA--C 1.518 0.28 0 C-N-CA 125.383 1.468 . . . . 0.0 111.518 178.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 76.0 m -76.36 175.16 9.38 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 122.312 1.054 . . . . 0.0 111.231 178.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -125.88 -22.99 4.05 Favored 'General case' 0 C--N 1.334 -0.095 0 C-N-CA 125.164 1.386 . . . . 0.0 110.499 -174.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -62.95 121.2 12.96 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 124.732 1.213 . . . . 0.0 108.988 -177.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -74.16 150.68 40.3 Favored 'General case' 0 N--CA 1.454 -0.254 0 O-C-N 121.019 -1.051 . . . . 0.0 109.916 172.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -111.25 86.87 6.8 Favored Pre-proline 0 CA--C 1.532 0.279 0 C-N-CA 124.689 1.196 . . . . 0.0 108.717 173.185 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -64.39 132.88 35.16 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 121.682 1.588 . . . . 0.0 108.973 174.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.8 mt -134.56 101.28 4.9 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 -178.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.16 -38.14 87.36 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 118.559 0.618 . . . . 0.0 111.058 -169.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.0 t -151.77 180.0 7.94 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 121.964 0.887 . . . . 0.0 110.418 172.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.64 -28.79 68.83 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 125.081 1.352 . . . . 0.0 112.613 -173.414 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -59.5 -39.8 85.01 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.015 0.825 . . . . 0.0 110.439 178.255 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -60.76 -48.58 81.18 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 124.611 1.165 . . . . 0.0 109.692 177.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 25.4 t-105 -58.69 -47.96 82.74 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 123.401 0.68 . . . . 0.0 111.322 175.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -64.61 -28.34 69.56 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 123.238 0.615 . . . . 0.0 110.982 -176.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.9 mtp-105 . . . . . 0 N--CA 1.466 0.372 0 C-N-CA 123.392 0.677 . . . . 0.0 112.034 168.481 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.0 mt . . . . . 0 C--O 1.231 0.13 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -111.56 148.49 33.13 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 124.498 1.119 . . . . 0.0 109.755 -170.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -57.96 134.84 56.71 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 161.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 89.56 3.86 74.11 Favored Glycine 0 CA--C 1.531 1.057 0 CA-C-O 118.526 -1.152 . . . . 0.0 115.256 -177.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -70.25 -2.7 14.11 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 120.206 2.003 . . . . 0.0 115.675 -170.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.4 ttmm 45.96 117.28 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 130.94 3.696 . . . . 0.0 115.685 170.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 12.9 mt -103.35 159.79 15.26 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.324 167.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 91.1 t -137.0 154.91 31.95 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 C-N-CA 127.369 2.267 . . . . 0.0 105.09 163.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -123.69 -177.25 3.68 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.966 2.106 . . . . 0.0 111.496 -178.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.71 3.03 4.43 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.796 1.639 . . . . 0.0 113.247 178.246 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -123.55 16.71 9.63 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.696 1.998 . . . . 0.0 111.111 177.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 62.74 18.89 11.03 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.904 1.282 . . . . 0.0 111.889 175.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -70.87 108.47 4.52 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 119.959 -1.713 . . . . 0.0 108.672 170.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 56.5 m -69.49 151.06 46.5 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 119.451 -0.899 . . . . 0.0 108.576 164.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -137.37 161.07 37.28 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 125.241 1.416 . . . . 0.0 108.252 169.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 25.6 t -134.78 137.67 50.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 C-N-CA 130.288 3.435 . . . . 0.0 106.018 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 16.1 tp -85.84 133.21 33.98 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 170.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -110.1 174.31 5.92 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.534 1.134 . . . . 0.0 110.843 176.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -59.9 -18.61 46.11 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.989 1.716 . . . . 0.0 112.682 176.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -76.3 -7.62 55.32 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.167 0.987 . . . . 0.0 112.033 173.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 60.3 6.76 1.09 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 128.854 2.861 . . . . 0.0 114.815 -171.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 2.1 p-80 -76.11 161.78 28.56 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 119.641 1.11 . . . . 0.0 110.261 164.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 66.1 m95 -103.72 90.77 3.75 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 125.276 1.43 . . . . 0.0 107.943 176.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -78.62 163.41 61.28 Favored Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 124.53 1.132 . . . . 0.0 110.867 179.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.64 162.13 40.43 Favored 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.337 2.025 . . . . 0.0 110.595 -176.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -150.34 45.08 0.88 Allowed 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.348 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 69.03 165.11 0.13 Allowed Pre-proline 0 C--O 1.239 0.548 0 C-N-CA 127.375 2.27 . . . . 0.0 111.193 -174.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -72.82 -175.73 2.02 Favored 'Trans proline' 0 N--CA 1.447 -1.231 0 C-N-CA 121.409 1.406 . . . . 0.0 109.726 162.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.4 tt -129.78 143.41 48.91 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 124.615 1.166 . . . . 0.0 107.935 -174.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -81.54 166.41 17.76 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.85 2.367 . . . . 0.0 110.645 -175.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -60.5 -26.36 82.63 Favored 'Trans proline' 0 CA--C 1.536 0.599 0 C-N-CA 121.153 1.236 . . . . 0.0 112.588 179.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -84.29 -18.0 37.79 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 124.892 1.277 . . . . 0.0 113.078 176.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.45 -25.02 75.29 Favored Glycine 0 C--N 1.341 0.83 0 N-CA-C 111.225 -0.75 . . . . 0.0 111.225 -173.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 26.8 tp -65.02 -49.63 69.43 Favored 'General case' 0 C--N 1.339 0.131 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 177.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . 0.42 HD21 ' CG ' ' A' ' 98' ' ' HIS . 2.8 m120 -56.58 -39.34 73.34 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.066 0.947 . . . . 0.0 109.304 173.157 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -65.9 -34.32 77.85 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.696 0.798 . . . . 0.0 112.146 178.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.7 mp -62.17 -64.0 1.07 Allowed 'General case' 0 C--N 1.34 0.173 0 O-C-N 121.076 -1.015 . . . . 0.0 109.044 168.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 32.9 mm -60.37 -26.96 38.68 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 123.167 0.587 . . . . 0.0 110.987 -170.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.74 -41.08 6.55 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 125.921 1.688 . . . . 0.0 111.714 169.685 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.45 -57.79 7.43 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 118.949 0.795 . . . . 0.0 110.765 -176.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 13.8 t60 -54.62 -48.01 72.73 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.659 1.184 . . . . 0.0 110.112 174.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 58.3 m -65.29 -37.01 85.83 Favored 'General case' 0 C--O 1.225 -0.199 0 O-C-N 120.849 -1.157 . . . . 0.0 111.231 -177.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -77.95 -16.91 57.78 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 119.154 0.888 . . . . 0.0 112.525 -178.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . 0.257 2.0 t -89.53 -30.27 18.34 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 119.51 1.05 . . . . 0.0 110.035 174.478 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 80.0 mt -96.07 -9.69 30.25 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 119.403 1.001 . . . . 0.0 112.966 178.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 73.16 28.82 65.57 Favored Glycine 0 CA--C 1.527 0.843 0 C-N-CA 125.453 1.501 . . . . 0.0 113.822 -178.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 27.4 m-70 . . . . . 0 CA--C 1.539 0.528 0 CA-C-N 118.497 1.149 . . . . 0.0 111.871 -176.957 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . 0.42 ' CG ' HD21 ' A' ' 79' ' ' ASN . 66.6 m80 . . . . . 0 CA--C 1.532 0.281 0 N-CA-C 111.189 0.07 . . . . 0.0 111.189 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 97.8 mt -148.93 134.6 18.75 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.133 0.973 . . . . 0.0 108.883 -152.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 41.4 t-80 -69.39 -39.2 78.13 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 120.869 0.366 . . . . 0.0 111.253 178.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 5.2 t -164.29 -174.14 3.39 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.194 1.398 . . . . 0.0 108.895 176.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 88.9 t -61.05 -37.68 77.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 C-N-CA 125.622 1.569 . . . . 0.0 111.585 -176.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 11.4 ttm -57.56 -48.19 80.0 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 118.933 0.788 . . . . 0.0 110.286 177.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -54.34 -41.35 68.99 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 125.704 1.602 . . . . 0.0 110.254 -177.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.47 -47.9 72.41 Favored 'General case' 0 C--O 1.227 -0.113 0 C-N-CA 125.026 1.33 . . . . 0.0 111.766 177.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 38.5 mm -61.73 -43.72 97.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 -176.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -68.08 -34.49 76.5 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 118.671 -0.681 . . . . 0.0 111.398 178.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 33.0 t80 -60.47 -65.57 0.67 Allowed 'General case' 0 C--O 1.226 -0.133 0 C-N-CA 123.889 0.876 . . . . 0.0 109.433 174.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.0 mp -48.16 -49.91 30.77 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 125.246 1.418 . . . . 0.0 111.766 178.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 16.7 m-80 -65.54 -31.7 72.89 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 118.781 -0.628 . . . . 0.0 112.358 -178.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -75.86 -27.46 57.8 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 117.985 -1.007 . . . . 0.0 111.292 176.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 59.8 mt . . . . . 0 N--CA 1.457 -0.111 0 CA-C-N 119.406 1.003 . . . . 0.0 108.789 179.915 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 29.3 p . . . . . 0 N--CA 1.45 -0.452 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -73.49 94.63 0.85 Allowed 'Trans proline' 0 N--CA 1.444 -1.432 0 C-N-CA 121.837 1.691 . . . . 0.0 108.728 174.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 75.17 147.27 0.12 Allowed Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 128.35 2.66 . . . . 0.0 111.873 -174.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -79.39 -32.35 1.73 Allowed 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 123.264 2.643 . . . . 0.0 112.379 170.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -83.87 -6.6 59.46 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.851 1.26 . . . . 0.0 112.764 -176.04 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.44 132.29 49.6 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.838 1.255 . . . . 0.0 108.105 164.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.8 mm -115.33 115.83 50.61 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.131 0 C-N-CA 124.823 1.249 . . . . 0.0 107.966 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 71.2 m95 -60.6 151.33 71.44 Favored Pre-proline 0 C--O 1.235 0.296 0 C-N-CA 123.494 0.718 . . . . 0.0 111.725 177.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -72.32 174.15 49.54 Favored 'Cis proline' 0 CA--C 1.537 0.65 0 N-CA-C 115.266 1.218 . . . . 0.0 115.266 0.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -128.81 166.77 18.39 Favored 'General case' 0 C--N 1.344 0.339 0 C-N-CA 123.39 0.676 . . . . 0.0 112.817 -179.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 18.1 mt -139.49 99.63 3.78 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 127.795 2.438 . . . . 0.0 107.937 178.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 23.8 tp -70.44 152.95 43.49 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 117.883 -1.056 . . . . 0.0 108.444 169.41 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -144.87 85.95 1.77 Allowed 'General case' 0 C--O 1.234 0.267 0 CA-C-N 120.238 1.381 . . . . 0.0 111.588 170.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -44.45 127.28 5.82 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 125.728 1.611 . . . . 0.0 110.517 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.4 tp60 -68.49 90.77 0.39 Allowed 'General case' 0 N--CA 1.432 -1.366 0 C-N-CA 126.036 1.735 . . . . 0.0 111.142 -170.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 115.06 -17.55 17.12 Favored Glycine 0 CA--C 1.524 0.627 0 CA-C-O 118.267 -1.296 . . . . 0.0 112.173 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.463 ' C ' ' H ' ' A' ' 24' ' ' GLU . 3.8 t -71.38 -33.35 69.45 Favored 'General case' 0 C--O 1.22 -0.454 0 CA-C-N 118.881 1.341 . . . . 0.0 109.957 173.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 68.7 -20.83 0.15 Allowed 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.908 1.683 . . . . 0.0 112.552 -172.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.463 ' H ' ' C ' ' A' ' 22' ' ' CYS . 23.3 tt0 -64.86 138.26 58.27 Favored 'General case' 0 N--CA 1.441 -0.918 0 C-N-CA 125.308 1.443 . . . . 0.0 108.352 172.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.432 ' CD1' ' HA ' ' A' ' 82' ' ' ILE . 1.3 mt -96.98 150.6 20.58 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 124.164 0.986 . . . . 0.0 108.519 169.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -113.73 87.83 12.85 Favored Pre-proline 0 C--N 1.327 -0.403 0 C-N-CA 124.768 1.227 . . . . 0.0 110.226 175.104 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -64.23 137.43 56.33 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 123.083 2.522 . . . . 0.0 109.994 176.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.7 mt -141.47 117.12 10.32 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 106.783 -1.562 . . . . 0.0 106.783 -177.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -69.0 -53.59 19.74 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.235 0.541 . . . . 0.0 112.03 -173.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 64.3 p -138.85 165.11 27.89 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.983 0.913 . . . . 0.0 108.612 -175.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -50.59 -30.85 14.25 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 123.384 0.674 . . . . 0.0 112.652 -177.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.9 -42.54 76.15 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.257 1.023 . . . . 0.0 111.595 174.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.44 -47.32 79.53 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 121.216 -0.927 . . . . 0.0 110.484 179.038 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 41.0 t-105 -58.06 -47.04 84.35 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 176.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 -55.09 -58.41 7.76 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.474 0.709 . . . . 0.0 109.444 178.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.468 0.439 0 C-N-CA 125.336 1.455 . . . . 0.0 113.587 -178.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 85.1 mt . . . . . 0 C--O 1.235 0.299 0 CA-C-O 121.308 0.575 . . . . 0.0 109.637 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -149.85 162.33 40.51 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.616 1.166 . . . . 0.0 109.051 -173.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -71.39 105.01 3.37 Favored 'General case' 0 C--O 1.237 0.443 0 O-C-N 121.612 -0.68 . . . . 0.0 109.217 -163.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 122.47 5.31 8.61 Favored Glycine 0 CA--C 1.526 0.748 0 CA-C-O 117.433 -1.759 . . . . 0.0 114.787 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.95 -15.58 1.45 Allowed 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 117.255 2.317 . . . . 0.0 117.255 -175.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.5 ttmt 44.63 125.67 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.221 1 C-N-CA 132.171 4.188 . . . . 0.0 115.295 -177.005 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.7 mt -109.99 139.42 45.11 Favored 'General case' 0 CA--C 1.512 -0.51 0 O-C-N 120.942 -1.099 . . . . 0.0 108.089 166.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 55.2 t -113.01 151.29 14.92 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 N-CA-C 105.098 -2.186 . . . . 0.0 105.098 162.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -131.22 172.19 12.42 Favored 'General case' 0 N--CA 1.437 -1.118 0 C-N-CA 130.294 3.438 . . . . 0.0 108.617 -177.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.7 t -56.71 -20.69 23.11 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.36 1.464 . . . . 0.0 113.048 177.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -98.35 -0.09 44.43 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.096 1.758 . . . . 0.0 112.619 -169.641 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 59.63 15.3 4.55 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.989 1.716 . . . . 0.0 112.54 -171.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 48.1 m170 -70.18 106.4 3.28 Favored 'General case' 0 CA--C 1.529 0.15 0 O-C-N 120.076 -1.64 . . . . 0.0 109.638 164.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 2.9 t -71.86 151.57 43.3 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 174.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -139.1 153.77 48.06 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 124.55 1.14 . . . . 0.0 108.757 176.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 27.8 t -141.91 135.41 29.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 C-N-CA 127.526 2.33 . . . . 0.0 107.336 -176.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 29.5 tp -80.7 133.44 35.69 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 126.051 1.74 . . . . 0.0 107.719 176.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -125.83 170.35 11.71 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.14 0.976 . . . . 0.0 109.441 178.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -66.57 -29.3 69.34 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.12 0.968 . . . . 0.0 112.001 -167.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -66.73 8.8 0.22 Allowed 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.795 1.238 . . . . 0.0 112.954 171.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 63.48 28.25 15.31 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 126.434 1.894 . . . . 0.0 111.674 168.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.4 p-80 -114.75 166.52 11.66 Favored 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 124.948 1.299 . . . . 0.0 110.191 170.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 65.3 m95 -103.71 98.09 8.01 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 126.638 1.975 . . . . 0.0 106.785 174.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 63.3 t-80 -71.08 143.52 88.79 Favored Pre-proline 0 CA--C 1.539 0.55 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 178.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -72.08 113.39 3.67 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 123.806 3.004 . . . . 0.0 109.669 172.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -91.89 34.54 1.0 Allowed 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.95 1.7 . . . . 0.0 111.99 -173.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 64.89 166.27 0.12 Allowed Pre-proline 0 CA--C 1.547 0.849 0 C-N-CA 126.684 1.994 . . . . 0.0 111.759 -175.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -67.03 -177.8 1.13 Allowed 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 121.931 1.754 . . . . 0.0 112.626 178.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.2 tt -132.61 143.88 50.62 Favored Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 126.053 1.741 . . . . 0.0 108.745 -175.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -80.83 164.4 20.41 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 123.005 2.47 . . . . 0.0 111.968 -176.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -61.44 -10.87 17.41 Favored 'Trans proline' 0 CA--C 1.528 0.224 0 C-N-CA 123.013 2.475 . . . . 0.0 115.441 178.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -106.34 -15.59 14.79 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.043 1.737 . . . . 0.0 113.505 175.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.59 -37.99 95.59 Favored Glycine 0 CA--C 1.529 0.93 0 CA-C-N 119.051 0.841 . . . . 0.0 111.301 -177.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.3 tp -52.74 -47.74 67.18 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 125.291 1.436 . . . . 0.0 108.384 177.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -75.64 -17.34 60.02 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 127.625 2.37 . . . . 0.0 110.527 -170.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -84.31 -42.39 15.86 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.043 1.337 . . . . 0.0 110.502 170.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.5 mp -58.99 -52.74 64.46 Favored 'General case' 0 N--CA 1.46 0.073 0 C-N-CA 123.196 0.598 . . . . 0.0 109.895 176.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.432 ' HA ' ' CD1' ' A' ' 25' ' ' LEU . 4.1 mm -62.1 -33.51 58.84 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.148 0 C-N-CA 123.675 0.79 . . . . 0.0 110.653 178.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.86 -42.36 58.8 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 121.455 -0.778 . . . . 0.0 110.923 171.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.75 -42.64 90.68 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 118.997 -0.525 . . . . 0.0 112.3 -177.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 7.8 t60 -60.14 -53.44 57.77 Favored 'General case' 0 C--O 1.222 -0.346 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 172.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 94.8 m -57.03 -42.24 80.07 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 121.361 -0.837 . . . . 0.0 110.201 -174.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.42 -22.26 66.78 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-O 116.832 -1.556 . . . . 0.0 114.239 -178.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . 0.377 11.8 t -93.57 -13.39 27.77 Favored 'General case' 0 C--N 1.345 0.403 0 CA-C-N 121.3 1.863 . . . . 0.0 110.925 -177.06 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -107.85 -14.61 14.74 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 126.322 1.849 . . . . 0.0 111.625 -179.248 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 77.87 15.21 81.49 Favored Glycine 0 CA--C 1.53 0.988 0 CA-C-O 118.416 -1.214 . . . . 0.0 113.27 -172.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 69.2 m-70 . . . . . 0 C--O 1.235 0.315 0 CA-C-N 119.163 1.482 . . . . 0.0 109.57 -178.003 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 4.6 t-160 . . . . . 0 CA--C 1.546 0.826 0 CA-C-O 117.688 -1.148 . . . . 0.0 109.749 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 93.3 mt -141.63 153.56 44.83 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 121.851 2.114 . . . . 0.0 110.639 174.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 23.9 t-80 -75.37 -39.25 59.45 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.716 175.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -175.05 178.28 1.79 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 122.948 0.499 . . . . 0.0 111.464 -167.601 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 58.4 t -64.45 -39.47 85.68 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 123.653 0.781 . . . . 0.0 109.892 -176.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 3.5 tpt -56.92 -32.1 65.6 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.795 -0.566 . . . . 0.0 111.796 177.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -72.2 -48.74 40.8 Favored 'General case' 0 C--O 1.226 -0.176 0 C-N-CA 124.429 1.091 . . . . 0.0 108.221 176.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.06 -50.08 67.54 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 125.224 1.41 . . . . 0.0 112.542 -178.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 37.6 mm -57.17 -45.81 84.58 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -178.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -74.03 -24.73 59.59 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.279 1.032 . . . . 0.0 112.733 -175.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -67.26 -70.46 0.25 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.993 0.917 . . . . 0.0 109.088 168.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 9.4 mp -51.39 -51.19 56.81 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 127.02 2.128 . . . . 0.0 113.298 -177.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -64.23 -12.6 42.39 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 118.186 -0.911 . . . . 0.0 112.28 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -100.85 -7.25 23.74 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 120.105 1.32 . . . . 0.0 112.303 175.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 95.8 mt . . . . . 0 C--O 1.235 0.294 0 C-N-CA 124.79 1.236 . . . . 0.0 110.194 173.619 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.235 0.307 0 CA-C-O 118.364 -0.827 . . . . 0.0 109.159 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -69.16 -55.33 0.2 Allowed 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 121.009 1.139 . . . . 0.0 110.555 -167.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 5.4 t-80 -144.5 148.36 40.0 Favored Pre-proline 0 N--CA 1.451 -0.407 0 C-N-CA 126.614 1.965 . . . . 0.0 106.409 172.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -72.96 -28.98 12.53 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 CA-C-N 120.919 1.364 . . . . 0.0 112.658 179.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -80.63 -10.02 59.76 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 118.726 -0.654 . . . . 0.0 112.06 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.5 tt -58.76 132.65 54.54 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 119.084 0.856 . . . . 0.0 109.851 168.411 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.417 ' CG1' HD22 ' A' ' 55' ' ' ASN . 45.6 mm -113.77 113.01 42.67 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 175.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 76.6 m95 -57.8 150.11 49.9 Favored Pre-proline 0 C--O 1.241 0.637 0 C-N-CA 123.255 0.622 . . . . 0.0 111.346 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -71.72 173.22 52.2 Favored 'Cis proline' 0 CA--C 1.54 0.785 0 N-CA-C 114.768 1.026 . . . . 0.0 114.768 0.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -131.17 167.47 19.1 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 124.29 1.036 . . . . 0.0 111.818 176.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 27.1 mt -139.54 105.09 5.09 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 126.851 2.061 . . . . 0.0 110.031 -175.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.54 ' CD1' ' H ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -81.56 165.01 21.52 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 123.602 0.761 . . . . 0.0 109.592 168.534 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.54 ' H ' ' CD1' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -156.64 88.04 1.04 Allowed 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 119.445 -0.312 . . . . 0.0 110.445 163.248 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 22.5 mt-30 -51.6 135.6 28.12 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -166.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -68.26 116.73 9.19 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 -176.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 105.3 -2.79 40.19 Favored Glycine 0 CA--C 1.525 0.704 0 CA-C-O 117.398 -1.779 . . . . 0.0 113.615 -173.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.83 172.75 7.94 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 119.956 1.878 . . . . 0.0 109.929 165.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -110.95 -17.62 13.26 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 125.501 1.52 . . . . 0.0 108.881 177.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -76.24 127.98 34.0 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 -177.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.405 ' CD1' ' HA ' ' A' ' 82' ' ' ILE . 1.3 mt -82.53 159.51 22.81 Favored 'General case' 0 C--O 1.231 0.1 0 C-N-CA 123.48 0.712 . . . . 0.0 109.539 170.445 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -122.6 88.95 49.79 Favored Pre-proline 0 C--N 1.328 -0.33 0 C-N-CA 125.665 1.586 . . . . 0.0 110.71 -173.475 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -62.09 126.3 18.39 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 123.777 2.985 . . . . 0.0 109.961 179.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -115.28 100.37 8.08 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 107.154 -1.425 . . . . 0.0 107.154 169.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 67.5 mtt-85 -52.64 -53.16 50.81 Favored 'General case' 0 N--CA 1.463 0.196 0 C-N-CA 124.584 1.154 . . . . 0.0 110.59 175.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.0 t -144.23 -177.75 5.62 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 122.313 1.054 . . . . 0.0 109.828 178.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -50.92 -39.1 53.78 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 126.571 1.948 . . . . 0.0 110.841 178.142 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -43.03 98.23 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.393 0.677 . . . . 0.0 111.222 178.185 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -68.2 -26.82 65.92 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 124.33 1.052 . . . . 0.0 110.773 -177.467 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 60.8 t-105 -79.25 -41.18 28.79 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 123.663 0.785 . . . . 0.0 111.81 170.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -58.04 -45.66 86.63 Favored 'General case' 0 N--CA 1.462 0.132 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 178.167 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.466 0.344 0 C-N-CA 125.209 1.404 . . . . 0.0 112.363 173.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 49.0 mt . . . . . 0 CA--C 1.512 -0.491 0 N-CA-C 105.157 -2.164 . . . . 0.0 105.157 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -121.1 164.44 16.82 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 123.584 0.754 . . . . 0.0 109.81 -178.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.407 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 13.3 m-85 -60.34 138.64 57.93 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 176.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 84.2 9.12 82.67 Favored Glycine 0 CA--C 1.524 0.614 0 CA-C-O 119.106 -0.83 . . . . 0.0 113.496 174.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -65.46 -25.88 67.7 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 119.41 1.605 . . . . 0.0 112.485 -171.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 19.9 ttmt 75.12 145.5 0.08 Allowed 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 129.523 3.129 . . . . 0.0 112.421 175.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 9.4 tp -135.57 157.86 45.82 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 107.521 -1.288 . . . . 0.0 107.521 171.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 24.2 t -134.45 141.89 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.74 0 C-N-CA 127.456 2.302 . . . . 0.0 106.27 167.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -104.11 176.65 5.08 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.897 1.279 . . . . 0.0 112.067 167.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -69.54 -5.41 24.08 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 -179.581 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.417 HD22 ' CG1' ' A' ' 12' ' ' ILE . 70.3 m-80 -89.87 -1.27 57.95 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 119.412 1.005 . . . . 0.0 111.252 170.016 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 70.13 18.97 6.88 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 127.08 2.152 . . . . 0.0 110.959 -171.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 23.4 m170 -66.88 117.24 8.71 Favored 'General case' 0 C--N 1.34 0.164 0 O-C-N 120.801 -1.187 . . . . 0.0 108.891 169.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 72.6 m -83.11 156.32 23.35 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 118.997 0.817 . . . . 0.0 110.11 169.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -144.71 158.45 43.78 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 125.968 1.707 . . . . 0.0 109.313 177.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 24.4 t -115.86 162.73 13.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 C-N-CA 127.885 2.474 . . . . 0.0 106.907 169.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 29.2 tp -111.82 133.45 54.02 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 166.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 62.1 mp0 -113.58 -172.8 2.14 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.742 2.017 . . . . 0.0 109.807 -171.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.407 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 2.5 mp0 -77.06 -18.31 58.15 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 120.734 -1.229 . . . . 0.0 113.3 178.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -75.25 -7.98 55.36 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 127.502 2.321 . . . . 0.0 113.444 -168.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 64.34 17.1 10.57 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 129.158 2.983 . . . . 0.0 114.376 -161.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.1 p-80 -93.94 162.4 13.91 Favored 'General case' 0 C--N 1.34 0.195 0 C-N-CA 125.881 1.672 . . . . 0.0 114.336 164.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 62.0 m95 -106.58 106.41 16.92 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 106.644 -1.613 . . . . 0.0 106.644 164.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -87.13 156.37 54.62 Favored Pre-proline 0 CA--C 1.545 0.773 0 C-N-CA 123.484 0.713 . . . . 0.0 109.104 175.083 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -79.78 156.21 24.03 Favored 'Trans proline' 0 N--CA 1.455 -0.759 0 C-N-CA 122.303 2.002 . . . . 0.0 111.989 -172.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -132.25 31.91 4.04 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.056 1.342 . . . . 0.0 110.991 -177.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 71.72 165.42 0.13 Allowed Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 128.115 2.566 . . . . 0.0 111.802 179.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -71.43 -179.18 3.43 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 121.677 1.585 . . . . 0.0 109.927 169.226 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 12.8 tp -133.68 150.89 76.02 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-O 118.56 -0.733 . . . . 0.0 111.699 -174.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -61.97 159.47 33.81 Favored 'Trans proline' 0 CA--C 1.536 0.589 0 C-N-CA 122.178 1.919 . . . . 0.0 111.173 166.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -67.88 -38.06 14.17 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 122.329 2.019 . . . . 0.0 111.245 -178.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -72.86 -11.02 60.43 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 124.162 0.985 . . . . 0.0 110.569 175.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -68.78 -28.5 73.05 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-O 118.934 -0.926 . . . . 0.0 111.416 171.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 46.5 tp -62.88 -54.15 43.18 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 118.523 1.161 . . . . 0.0 108.728 170.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -50.24 -43.92 53.17 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.588 1.155 . . . . 0.0 111.661 177.36 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -60.78 -36.82 79.94 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 126.099 1.76 . . . . 0.0 112.724 177.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -72.22 -54.4 9.72 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 119.181 0.9 . . . . 0.0 109.84 172.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.405 ' HA ' ' CD1' ' A' ' 25' ' ' LEU . 4.4 mm -50.01 -37.82 13.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 126.372 1.869 . . . . 0.0 110.553 -177.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.01 -40.62 6.66 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 125.687 1.595 . . . . 0.0 112.661 176.3 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.34 -58.36 8.86 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 119.573 1.078 . . . . 0.0 111.581 178.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -58.82 -45.48 89.88 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 124.166 0.986 . . . . 0.0 109.383 -179.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 96.0 m -73.32 -17.18 61.33 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 120.641 -1.287 . . . . 0.0 112.774 -176.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -84.47 -20.62 31.42 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 119.396 0.998 . . . . 0.0 112.17 173.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.4 t -100.87 -17.35 16.89 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.37 0.532 . . . . 0.0 111.009 -178.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 52.2 mt -102.18 2.83 37.74 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.973 1.309 . . . . 0.0 111.166 165.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 66.59 15.4 64.0 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 125.187 1.375 . . . . 0.0 115.692 171.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 37.4 m-70 . . . . . 0 C--O 1.235 0.291 0 CA-C-N 119.5 1.65 . . . . 0.0 112.648 -174.14 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.226 -0.149 0 CA-C-O 121.007 0.432 . . . . 0.0 111.176 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 91.4 mt -155.08 121.87 5.42 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 126.259 1.824 . . . . 0.0 107.351 -155.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 32.1 t-80 -67.88 -37.1 81.36 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 117.889 0.313 . . . . 0.0 111.371 171.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 4.7 t -158.92 176.12 12.71 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.781 0.832 . . . . 0.0 111.477 -171.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 79.0 t -55.77 -36.9 44.85 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 C-N-CA 124.19 0.996 . . . . 0.0 108.988 167.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 26.0 tpp -60.01 -39.6 86.37 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.611 0.764 . . . . 0.0 112.311 178.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -61.28 -52.77 63.35 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 176.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.77 -41.7 70.82 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 125.005 1.322 . . . . 0.0 112.338 -171.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 22.4 mm -56.73 -46.89 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.266 0 CA-C-N 120.03 1.286 . . . . 0.0 111.127 -177.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -79.83 -36.89 36.18 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 118.164 0.438 . . . . 0.0 110.194 -178.27 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -59.77 -51.6 69.06 Favored 'General case' 0 C--N 1.337 0.056 0 C-N-CA 125.09 1.356 . . . . 0.0 110.978 -178.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 95.8 mt -68.06 -31.27 70.79 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 125.083 1.353 . . . . 0.0 110.902 -177.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -65.99 -40.15 90.93 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-O 118.894 -0.574 . . . . 0.0 110.8 175.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -75.07 0.68 15.25 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.583 1.153 . . . . 0.0 113.071 -179.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 45.4 mt . . . . . 0 N--CA 1.457 -0.109 0 CA-C-N 118.95 0.795 . . . . 0.0 110.488 166.766 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.7 p . . . . . 0 CA--C 1.537 0.479 0 N-CA-C 110.546 -0.168 . . . . 0.0 110.546 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -67.88 -55.0 0.29 Allowed 'Trans proline' 0 N--CA 1.459 -0.5 0 C-N-CA 122.467 2.111 . . . . 0.0 111.267 -169.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -135.75 144.29 48.23 Favored Pre-proline 0 C--O 1.238 0.482 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 176.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -77.4 -17.75 14.43 Favored 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 122.394 2.063 . . . . 0.0 111.965 -176.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -81.43 -26.43 35.36 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 117.636 -1.174 . . . . 0.0 111.964 173.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 tt -56.68 133.34 53.85 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.295 0.952 . . . . 0.0 109.823 -171.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.415 ' CG1' HD22 ' A' ' 55' ' ' ASN . 46.7 mm -112.71 116.37 52.4 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.123 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 -175.051 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 76.5 m95 -60.52 154.35 55.71 Favored Pre-proline 0 N--CA 1.45 -0.444 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.64 176.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -72.15 162.94 88.84 Favored 'Cis proline' 0 N--CA 1.458 -0.597 0 C-N-CA 124.853 -0.895 . . . . 0.0 112.684 -3.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -131.96 166.53 21.48 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 121.773 0.797 . . . . 0.0 110.966 179.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 38.6 mt -138.26 106.5 5.77 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 124.917 1.287 . . . . 0.0 108.813 -170.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.2 tp -84.67 148.79 26.23 Favored 'General case' 0 C--O 1.236 0.395 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 171.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -142.54 96.67 2.98 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 119.612 1.097 . . . . 0.0 108.592 167.135 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -55.15 151.57 9.14 Favored 'General case' 0 C--O 1.24 0.575 0 O-C-N 124.628 1.205 . . . . 0.0 112.425 -164.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -71.02 88.56 0.77 Allowed 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.512 0.672 . . . . 0.0 110.967 -177.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 137.15 -34.3 2.21 Favored Glycine 0 CA--C 1.524 0.633 0 C-N-CA 126.251 1.881 . . . . 0.0 110.618 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 85.3 m -76.86 177.07 7.96 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 122.89 1.329 . . . . 0.0 111.257 -178.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -128.82 -35.25 1.89 Allowed 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 126.712 2.005 . . . . 0.0 109.216 -175.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -59.69 131.71 51.76 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.231 1.412 . . . . 0.0 107.856 169.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -84.17 150.73 25.31 Favored 'General case' 0 CA--C 1.515 -0.393 0 C-N-CA 124.351 1.061 . . . . 0.0 108.678 164.232 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -103.68 88.64 1.89 Allowed Pre-proline 0 C--N 1.327 -0.403 0 C-N-CA 128.294 2.637 . . . . 0.0 107.549 176.277 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -56.89 127.13 24.59 Favored 'Trans proline' 0 N--CA 1.45 -1.037 0 N-CA-C 108.988 -1.197 . . . . 0.0 108.988 169.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -118.22 103.54 9.94 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 106.089 -1.819 . . . . 0.0 106.089 166.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 67.8 mtt85 -56.74 -42.51 79.41 Favored 'General case' 0 CA--C 1.519 -0.213 0 O-C-N 122.279 -0.263 . . . . 0.0 110.562 174.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.0 t -157.49 -177.47 6.62 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 118.344 0.52 . . . . 0.0 110.782 -177.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -51.95 -42.37 62.8 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 125.411 1.485 . . . . 0.0 110.695 174.256 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -54.44 -50.77 66.87 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-N 118.713 0.688 . . . . 0.0 110.639 175.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -57.2 -45.6 83.64 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.217 1.407 . . . . 0.0 110.368 178.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 39.6 t-105 -58.3 -40.93 83.31 Favored 'General case' 0 C--N 1.34 0.18 0 C-N-CA 123.8 0.84 . . . . 0.0 111.274 176.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.91 -45.25 90.76 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 178.472 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 8.4 mtt180 . . . . . 0 N--CA 1.456 -0.149 0 C-N-CA 124.056 0.943 . . . . 0.0 111.531 -168.978 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 72.3 mt . . . . . 0 N--CA 1.452 -0.338 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -158.91 131.14 6.7 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 104.652 -2.351 . . . . 0.0 104.652 -167.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.403 ' CD1' HD11 ' A' ' 61' ' ' LEU . 52.8 m-85 -60.07 144.08 50.46 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 -176.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.11 8.28 66.94 Favored Glycine 0 N--CA 1.443 -0.848 0 CA-C-O 118.292 -1.282 . . . . 0.0 114.812 -179.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.47 -9.76 14.31 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.542 1.937 . . . . 0.0 115.207 -174.029 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 15.8 ttmt 51.09 135.55 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.08 1 C-N-CA 132.025 4.13 . . . . 0.0 115.66 174.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 11.5 mt -129.38 157.57 41.58 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 121.088 -1.007 . . . . 0.0 109.568 174.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 37.4 t -135.26 141.35 42.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 127.476 2.31 . . . . 0.0 106.026 173.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -118.1 179.63 4.04 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.803 1.641 . . . . 0.0 111.781 172.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 98.5 p -61.12 -27.3 68.28 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.876 1.271 . . . . 0.0 113.653 -175.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.415 HD22 ' CG1' ' A' ' 12' ' ' ILE . 14.1 m-80 -82.73 1.22 39.84 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 125.64 1.576 . . . . 0.0 110.745 178.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 61.3 23.73 13.92 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.542 1.537 . . . . 0.0 110.405 -170.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 27.8 m170 -61.08 124.04 19.39 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 120.699 1.59 . . . . 0.0 107.515 164.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -88.5 145.85 25.51 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 107.138 -1.431 . . . . 0.0 107.138 166.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -135.99 155.69 49.87 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.192 0.997 . . . . 0.0 109.028 174.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 40.0 t -141.62 131.63 25.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 C-N-CA 128.046 2.538 . . . . 0.0 107.074 -177.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.403 HD11 ' CD1' ' A' ' 47' ' ' TYR . 0.2 OUTLIER -74.55 123.33 24.6 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 107.159 -1.422 . . . . 0.0 107.159 169.436 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -110.54 167.31 10.31 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.225 0.921 . . . . 0.0 109.438 173.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -59.54 -4.16 0.58 Allowed 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.848 1.259 . . . . 0.0 113.643 178.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -77.87 -2.73 38.11 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 120.606 -1.309 . . . . 0.0 111.755 167.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 70.68 -3.0 2.06 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 126.613 1.965 . . . . 0.0 112.286 -178.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -89.1 166.17 14.03 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 123.604 0.762 . . . . 0.0 110.737 175.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 68.5 m95 -107.35 97.41 7.17 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 125.616 1.567 . . . . 0.0 107.012 173.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 54.9 t-80 -79.81 145.09 61.28 Favored Pre-proline 0 CA--C 1.543 0.705 0 CA-C-O 118.122 -0.942 . . . . 0.0 110.222 -175.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -68.47 109.0 1.94 Allowed 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 124.166 3.244 . . . . 0.0 112.5 172.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.0 21.05 0.59 Allowed 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.287 1.435 . . . . 0.0 111.858 170.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 67.17 165.85 0.12 Allowed Pre-proline 0 C--O 1.237 0.434 0 C-N-CA 127.3 2.24 . . . . 0.0 111.817 -176.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -65.05 163.9 26.99 Favored 'Trans proline' 0 N--CA 1.447 -1.23 0 C-N-CA 120.81 1.007 . . . . 0.0 112.39 174.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 15.8 tp -118.95 146.75 40.95 Favored Pre-proline 0 CA--C 1.535 0.39 0 C-N-CA 126.279 1.832 . . . . 0.0 110.102 -173.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.49 164.35 31.23 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 122.278 1.985 . . . . 0.0 111.523 173.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -59.02 -33.54 98.77 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.843 2.362 . . . . 0.0 112.353 178.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -77.58 -24.71 49.7 Favored 'General case' 0 N--CA 1.454 -0.239 0 O-C-N 121.697 -0.627 . . . . 0.0 111.239 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -64.43 -29.13 74.25 Favored Glycine 0 CA--C 1.532 1.127 0 CA-C-N 118.4 0.545 . . . . 0.0 112.396 -174.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 37.5 tp -55.73 -53.0 61.98 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 124.871 1.268 . . . . 0.0 109.638 169.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -64.25 -25.78 68.21 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.255 0.622 . . . . 0.0 111.3 -173.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -72.26 -20.41 61.53 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.761 0.824 . . . . 0.0 112.521 177.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 67.1 mt -83.17 -50.22 8.67 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 118.924 0.784 . . . . 0.0 109.026 168.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.8 mm -50.87 -40.28 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 126.094 1.758 . . . . 0.0 111.655 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.82 -41.81 7.33 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 125.104 1.362 . . . . 0.0 110.751 176.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -73.78 -44.77 55.02 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -178.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 5.6 t60 -62.87 -45.06 94.32 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 119.682 1.128 . . . . 0.0 108.843 177.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 91.9 m -62.69 -41.05 98.92 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.484 177.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.69 -33.31 73.74 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -178.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 9.2 t -74.4 -38.89 62.98 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.971 0.805 . . . . 0.0 109.042 -177.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 78.4 mt -87.41 -52.11 5.55 Favored 'General case' 0 N--CA 1.462 0.166 0 O-C-N 121.659 -0.651 . . . . 0.0 109.772 -173.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 115.98 58.06 0.33 Allowed Glycine 0 CA--C 1.523 0.535 0 C-N-CA 125.971 1.748 . . . . 0.0 108.918 -179.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 13.3 m-70 . . . . . 0 C--O 1.236 0.372 0 C-N-CA 123.777 0.831 . . . . 0.0 110.895 -175.65 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.455 -0.207 0 CA-C-O 119.194 -0.432 . . . . 0.0 110.463 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 89.7 mt -154.3 163.38 40.23 Favored 'General case' 0 CA--C 1.514 -0.433 0 C-N-CA 127.119 2.168 . . . . 0.0 109.88 -170.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 16.0 t-160 -86.56 -37.39 18.2 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 123.692 0.797 . . . . 0.0 112.644 169.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 4.5 t -172.41 -178.92 2.11 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 118.582 0.628 . . . . 0.0 112.684 -165.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 45.2 t -68.05 -39.82 82.11 Favored 'Isoleucine or valine' 0 C--N 1.345 0.371 0 C-N-CA 124.048 0.939 . . . . 0.0 111.194 -179.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -59.89 -44.89 93.98 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 177.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.55 -49.71 67.09 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 127.388 2.275 . . . . 0.0 109.968 174.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.21 -56.29 24.0 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 124.924 1.29 . . . . 0.0 111.28 179.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 3.4 mm -60.17 -41.07 85.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -174.106 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -59.98 -50.05 75.27 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 124.032 0.933 . . . . 0.0 110.25 176.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -54.5 -67.46 0.26 Allowed 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 126.666 1.986 . . . . 0.0 110.022 178.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 6.9 mp -47.48 -49.95 24.44 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 125.266 1.426 . . . . 0.0 111.681 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 63.3 m-80 -79.44 -4.79 52.77 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -176.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -99.15 -25.59 14.48 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 119.559 1.072 . . . . 0.0 111.169 169.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 40.3 mt . . . . . 0 N--CA 1.45 -0.433 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 174.514 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 27.2 p . . . . . 0 C--O 1.238 0.457 0 N-CA-C 111.717 0.266 . . . . 0.0 111.717 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -74.53 95.66 0.95 Allowed 'Trans proline' 0 N--CA 1.45 -1.08 0 C-N-CA 123.244 2.63 . . . . 0.0 109.487 178.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 75.6 144.51 0.1 Allowed Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 128.294 2.638 . . . . 0.0 113.964 176.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -80.03 -20.56 8.69 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 122.877 2.385 . . . . 0.0 114.201 -178.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -78.12 -18.59 55.46 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 117.295 -1.336 . . . . 0.0 111.527 172.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 tt -60.89 127.0 29.44 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 121.276 1.853 . . . . 0.0 110.831 -174.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 44.6 mm -111.73 118.59 57.96 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.096 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 178.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 63.7 m95 -64.53 152.85 88.47 Favored Pre-proline 0 C--O 1.237 0.411 0 CA-C-O 118.53 -0.748 . . . . 0.0 110.5 173.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -70.17 160.2 89.66 Favored 'Cis proline' 0 N--CA 1.458 -0.593 0 C-N-CA 124.697 -0.96 . . . . 0.0 113.717 -1.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -119.6 168.36 11.1 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.972 0.909 . . . . 0.0 109.687 174.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 16.0 mt -140.25 91.25 2.43 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.885 2.074 . . . . 0.0 107.1 -179.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 26.8 tp -68.34 144.86 54.64 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 106.234 -1.765 . . . . 0.0 106.234 160.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -143.11 95.64 2.8 Favored 'General case' 0 CA--C 1.506 -0.743 0 N-CA-C 103.776 -2.675 . . . . 0.0 103.776 167.204 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -55.06 137.43 46.47 Favored 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 124.717 1.261 . . . . 0.0 109.861 -167.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.8 134.33 56.59 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-O 122.449 1.119 . . . . 0.0 109.051 175.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 97.73 -45.69 1.7 Allowed Glycine 0 CA--C 1.526 0.741 0 C-N-CA 126.251 1.881 . . . . 0.0 111.446 -172.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 66.3 m -68.44 165.59 18.57 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 118.216 1.008 . . . . 0.0 109.983 174.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -116.48 -29.3 6.2 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.407 1.483 . . . . 0.0 108.267 173.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -64.98 144.98 56.93 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 127.426 2.29 . . . . 0.0 109.738 174.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.1 mt -99.98 161.43 13.61 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 125.885 1.674 . . . . 0.0 110.152 -176.289 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -115.05 85.96 13.0 Favored Pre-proline 0 C--O 1.236 0.345 0 C-N-CA 125.201 1.4 . . . . 0.0 108.622 164.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -65.88 135.22 40.33 Favored 'Trans proline' 0 N--CA 1.453 -0.905 0 C-N-CA 121.987 1.791 . . . . 0.0 108.502 168.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.5 mt -134.2 100.45 4.7 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 -177.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.6 mtt180 -58.92 -47.39 85.18 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.144 0.497 . . . . 0.0 111.175 -168.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 66.3 p -141.87 175.98 9.29 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -172.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -54.13 -36.48 63.32 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-O 119.132 -0.461 . . . . 0.0 110.446 166.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -67.38 -16.77 64.43 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -174.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -80.95 -43.93 18.99 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.345 1.058 . . . . 0.0 109.647 171.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 76.4 t-105 -64.89 -37.82 88.91 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.144 0.978 . . . . 0.0 111.877 176.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.9 mm100 -52.61 -48.47 66.31 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 124.666 1.187 . . . . 0.0 109.055 177.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 45.4 mtp85 . . . . . 0 N--CA 1.462 0.135 0 C-N-CA 124.839 1.256 . . . . 0.0 112.236 179.601 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 93.5 mt . . . . . 0 N--CA 1.447 -0.594 0 N-CA-C 105.63 -1.989 . . . . 0.0 105.63 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 26.3 pt20 -157.6 130.33 7.45 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 104.628 -2.36 . . . . 0.0 104.628 -173.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -56.87 132.53 52.79 Favored 'General case' 0 C--O 1.243 0.733 0 N-CA-C 105.554 -2.017 . . . . 0.0 105.554 175.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 100.76 -0.25 55.29 Favored Glycine 0 CA--C 1.534 1.264 0 CA-C-O 118.989 -0.895 . . . . 0.0 115.239 -176.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.58 -19.87 28.59 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 119.874 1.837 . . . . 0.0 115.282 -174.214 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt 62.13 136.37 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 129.786 3.234 . . . . 0.0 113.718 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 8.4 tp -126.76 153.0 46.13 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 174.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 27.5 t -132.67 128.83 57.99 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 N-CA-C 103.783 -2.673 . . . . 0.0 103.783 172.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -97.23 177.76 5.46 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 122.06 0.933 . . . . 0.0 110.748 168.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.1 t -60.65 -19.88 59.37 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.162 1.385 . . . . 0.0 112.763 -178.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -84.32 -14.08 50.66 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 120.535 1.516 . . . . 0.0 113.084 -176.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 67.85 41.65 2.1 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 118.853 0.751 . . . . 0.0 109.72 -158.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 31.6 m170 -91.78 127.64 37.32 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 154.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -90.07 159.44 16.82 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 173.04 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -144.48 161.02 40.11 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 123.43 0.692 . . . . 0.0 110.539 177.301 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 25.7 t -139.07 131.05 36.33 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 128.096 2.558 . . . . 0.0 106.881 177.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.07 130.67 38.69 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 105.936 -1.875 . . . . 0.0 105.936 171.878 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -123.27 166.83 14.6 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.194 1.397 . . . . 0.0 109.692 177.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -57.74 -27.91 63.42 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 119.861 -1.774 . . . . 0.0 114.86 -166.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -75.39 15.11 0.49 Allowed 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 128.803 2.841 . . . . 0.0 112.369 177.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 68.7 9.23 7.22 Favored 'General case' 0 C--N 1.355 0.825 0 C-N-CA 125.61 1.564 . . . . 0.0 113.231 167.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 3.3 p-80 -101.31 159.48 15.23 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 122.386 1.089 . . . . 0.0 111.396 172.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 82.2 m95 -97.49 97.75 9.35 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 105.867 -1.901 . . . . 0.0 105.867 168.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 38.5 t-80 -71.28 143.77 88.63 Favored Pre-proline 0 CA--C 1.538 0.511 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 175.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -68.38 105.83 1.31 Allowed 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.314 2.676 . . . . 0.0 108.97 173.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.67 43.74 0.69 Allowed 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 126.03 1.732 . . . . 0.0 110.892 -176.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 60.73 166.47 0.09 OUTLIER Pre-proline 0 CA--C 1.542 0.637 0 C-N-CA 125.666 1.586 . . . . 0.0 111.942 -167.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -64.13 177.42 1.99 Allowed 'Trans proline' 0 N--CA 1.451 -1.002 0 C-N-CA 121.122 1.215 . . . . 0.0 111.977 168.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 6.0 tt -122.61 143.46 39.96 Favored Pre-proline 0 CA--C 1.534 0.347 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -79.73 165.27 22.59 Favored 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 122.085 1.857 . . . . 0.0 110.662 -175.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -65.17 -15.63 51.17 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 121.689 1.593 . . . . 0.0 113.248 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -89.32 -27.36 20.57 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.965 0.906 . . . . 0.0 112.925 172.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.54 -36.43 89.36 Favored Glycine 0 C--N 1.344 1.003 0 C-N-CA 124.738 1.161 . . . . 0.0 112.404 -166.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.0 tp -57.61 -48.24 79.96 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 125.687 1.595 . . . . 0.0 108.445 -178.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -62.29 -25.77 68.04 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 118.137 -0.935 . . . . 0.0 112.574 -173.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -72.61 -37.05 68.19 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.486 1.039 . . . . 0.0 111.551 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.4 mp -65.27 -49.98 67.51 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.837 0.855 . . . . 0.0 110.321 173.143 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 15.4 mm -52.19 -42.59 36.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 125.228 1.411 . . . . 0.0 109.178 174.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.4 ttt-85 -52.66 -18.04 1.6 Allowed 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 126.919 2.088 . . . . 0.0 114.61 175.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -90.1 -51.68 5.34 Favored 'General case' 0 CA--C 1.527 0.079 0 CA-C-N 120.235 1.379 . . . . 0.0 110.859 176.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -57.59 -48.15 80.19 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 121.958 0.885 . . . . 0.0 110.317 175.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 90.3 m -66.86 -36.66 82.82 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 121.52 -0.737 . . . . 0.0 110.877 -177.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.53 -46.72 84.7 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 118.521 0.601 . . . . 0.0 111.176 175.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.5 t -68.55 -31.44 70.66 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -172.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 91.0 mt -79.87 -57.44 3.65 Favored 'General case' 0 N--CA 1.463 0.185 0 O-C-N 121.06 -1.025 . . . . 0.0 110.619 176.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 127.25 39.66 0.37 Allowed Glycine 0 CA--C 1.533 1.18 0 C-N-CA 125.756 1.646 . . . . 0.0 112.853 -177.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 65.8 m-70 . . . . . 0 C--O 1.236 0.355 0 CA-C-N 119.21 1.505 . . . . 0.0 110.511 -177.185 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 . . . . . 0 N--CA 1.454 -0.238 0 CA-C-O 119.686 -0.197 . . . . 0.0 111.458 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 97.7 mt -135.42 116.9 14.76 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 125.231 1.412 . . . . 0.0 109.169 -156.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 10.6 t-80 -75.19 -26.31 58.91 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 172.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 79.1 p -159.21 172.98 17.07 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 119.481 1.037 . . . . 0.0 112.015 177.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 47.5 t -58.14 -43.46 85.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.261 166.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 1.2 ttm -55.85 -50.04 71.68 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 118.995 0.816 . . . . 0.0 110.355 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.41 -29.85 69.46 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 120.704 -0.398 . . . . 0.0 110.168 -178.31 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -69.27 -42.77 75.11 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 124.802 1.241 . . . . 0.0 112.823 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 32.7 mm -54.95 -39.86 51.0 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 172.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -69.34 -44.6 71.32 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 119.438 -0.315 . . . . 0.0 111.032 -178.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -57.71 -44.47 85.94 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.257 1.023 . . . . 0.0 111.001 176.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 12.4 mt -54.61 -35.97 63.97 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 124.929 1.292 . . . . 0.0 112.136 173.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -88.58 0.62 56.17 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.438 1.495 . . . . 0.0 112.516 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -112.92 3.52 16.34 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.872 1.669 . . . . 0.0 112.281 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 15.5 mt . . . . . 0 CA--C 1.527 0.07 0 C-N-CA 123.439 0.695 . . . . 0.0 109.809 167.074 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 19.5 p . . . . . 0 C--O 1.237 0.411 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -81.9 83.32 2.11 Favored 'Trans proline' 0 N--CA 1.444 -1.44 0 C-N-CA 121.723 1.616 . . . . 0.0 109.172 173.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 74.9 149.33 0.12 Allowed Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 127.706 2.402 . . . . 0.0 111.164 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -73.42 -34.0 6.34 Favored 'Trans proline' 0 CA--C 1.534 0.497 0 C-N-CA 122.007 1.804 . . . . 0.0 112.806 173.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -76.47 -11.89 59.95 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 118.807 0.73 . . . . 0.0 112.892 -171.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 tt -61.2 142.37 56.83 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.302 0.641 . . . . 0.0 110.066 167.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 34.1 mm -124.96 117.77 51.14 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 173.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 81.4 m95 -61.22 151.63 75.25 Favored Pre-proline 0 C--O 1.235 0.323 0 C-N-CA 122.771 0.429 . . . . 0.0 110.779 177.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -73.24 168.14 76.87 Favored 'Cis proline' 0 N--CA 1.457 -0.637 0 C-N-CA 125.122 -0.783 . . . . 0.0 114.027 -1.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -137.06 172.91 12.3 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.332 1.053 . . . . 0.0 110.685 177.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 17.2 mt -141.41 105.97 4.88 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 126.246 1.818 . . . . 0.0 108.681 -171.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 32.5 tp -87.92 150.35 23.53 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 125.262 1.425 . . . . 0.0 109.913 174.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -144.53 83.19 1.71 Allowed 'General case' 0 C--O 1.239 0.501 0 CA-C-N 120.176 1.353 . . . . 0.0 110.391 172.567 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -47.77 140.91 5.99 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 125.889 1.676 . . . . 0.0 113.296 -170.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -62.94 117.52 6.52 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.612 0.72 . . . . 0.0 110.642 -179.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 119.39 -62.21 0.47 Allowed Glycine 0 N--CA 1.451 -0.355 0 N-CA-C 108.575 -1.81 . . . . 0.0 108.575 -170.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -76.1 -179.75 5.16 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 123.434 1.588 . . . . 0.0 112.663 -166.763 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -124.78 -16.72 6.1 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 126.075 1.75 . . . . 0.0 109.319 176.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -77.47 109.98 11.86 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 -174.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.417 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 0.5 OUTLIER -65.65 148.3 51.98 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 119.604 -0.838 . . . . 0.0 108.947 172.419 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -104.34 87.68 1.78 Allowed Pre-proline 0 N--CA 1.447 -0.619 0 C-N-CA 126.314 1.846 . . . . 0.0 106.45 173.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -61.91 132.45 39.73 Favored 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 121.949 1.766 . . . . 0.0 108.526 170.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -118.61 103.28 9.56 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.923 1.289 . . . . 0.0 107.577 174.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 30.0 mtt180 -66.87 -38.99 87.37 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 119.415 1.007 . . . . 0.0 112.754 -169.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 15.5 p -152.55 166.81 30.87 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 126.367 1.867 . . . . 0.0 106.95 -170.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -47.75 -37.85 14.24 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.501 1.046 . . . . 0.0 112.636 175.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.02 -17.9 29.53 Favored 'General case' 0 C--O 1.231 0.095 0 C-N-CA 125.354 1.462 . . . . 0.0 114.275 -177.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -87.09 -47.28 9.04 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.479 1.912 . . . . 0.0 110.274 -175.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 53.4 t-105 -58.21 -34.69 70.67 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 120.659 -1.276 . . . . 0.0 110.267 176.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -51.21 -48.35 62.04 Favored 'General case' 0 C--N 1.341 0.234 0 C-N-CA 123.635 0.774 . . . . 0.0 110.105 173.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 5.2 mtt180 . . . . . 0 CA--C 1.517 -0.322 0 C-N-CA 125.711 1.604 . . . . 0.0 112.225 -169.377 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.463 ' N ' HE21 ' A' ' 46' ' ' GLN . 31.2 mt . . . . . 0 CA--C 1.523 -0.095 0 CA-C-O 121.235 0.54 . . . . 0.0 112.373 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.463 HE21 ' N ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -104.11 165.66 10.91 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.301 1.04 . . . . 0.0 111.06 -169.896 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 17.7 m-85 -73.08 79.29 1.23 Allowed 'General case' 0 C--O 1.234 0.264 0 C-N-CA 125.485 1.514 . . . . 0.0 109.711 177.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 150.84 -0.75 0.37 Allowed Glycine 0 N--CA 1.446 -0.696 0 CA-C-N 115.003 -0.999 . . . . 0.0 113.022 -167.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.04 -9.4 38.76 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 119.41 1.605 . . . . 0.0 114.621 -168.172 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt 44.23 126.44 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.785 1 C-N-CA 132.993 4.517 . . . . 0.0 114.837 179.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.0 tp -120.04 151.21 39.34 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 124.283 1.033 . . . . 0.0 108.252 170.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 33.8 t -134.8 146.27 31.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 105.535 -2.024 . . . . 0.0 105.535 161.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -120.95 -171.11 2.13 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 127.782 2.433 . . . . 0.0 110.701 178.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 88.8 p -63.93 -29.17 70.37 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -72.47 -14.72 61.74 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 124.121 0.968 . . . . 0.0 112.305 -178.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 51.15 57.33 6.75 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.196 0.999 . . . . 0.0 111.406 -177.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 11.0 m170 -120.75 13.02 11.49 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.377 1.071 . . . . 0.0 113.693 -171.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 57.0 m 43.05 124.99 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.541 1 C-N-CA 133.624 4.77 . . . . 0.0 113.573 176.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -126.54 141.88 51.72 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 121.362 -0.836 . . . . 0.0 109.171 178.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 30.5 t -130.9 146.13 34.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 C-N-CA 127.243 2.217 . . . . 0.0 105.698 169.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 21.4 tp -77.19 139.1 39.81 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 124.184 0.994 . . . . 0.0 108.607 177.104 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -108.0 167.2 10.16 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 125.789 1.636 . . . . 0.0 109.67 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -69.72 -9.85 56.02 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.82 0.848 . . . . 0.0 112.493 176.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.3 t0 -81.78 6.6 15.01 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.562 1.545 . . . . 0.0 111.087 166.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 53.01 8.25 0.09 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 128.053 2.541 . . . . 0.0 114.29 -169.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.2 p-80 -79.26 165.91 22.71 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 119.435 1.016 . . . . 0.0 109.405 169.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 75.6 m95 -102.45 122.31 44.07 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 106.838 -1.541 . . . . 0.0 106.838 170.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 63.0 t60 -98.99 143.68 26.82 Favored Pre-proline 0 CA--C 1.536 0.431 0 CA-C-O 118.379 -0.819 . . . . 0.0 109.186 -176.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -74.52 125.26 9.46 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 124.109 3.206 . . . . 0.0 110.754 173.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -116.72 39.33 3.21 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 125.021 1.328 . . . . 0.0 110.426 -168.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 67.61 164.35 0.13 Allowed Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 127.98 2.512 . . . . 0.0 111.949 -178.162 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -69.7 174.27 9.71 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.201 1.934 . . . . 0.0 114.26 -172.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.3 tt -128.75 143.64 49.32 Favored Pre-proline 0 CA--C 1.542 0.652 0 C-N-CA 126.663 1.985 . . . . 0.0 108.411 -175.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -85.6 165.45 10.57 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 123.14 2.56 . . . . 0.0 112.977 -178.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -60.15 -14.06 26.94 Favored 'Trans proline' 0 CA--C 1.531 0.361 0 C-N-CA 123.383 2.722 . . . . 0.0 114.77 177.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -101.31 -14.24 17.71 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.251 1.82 . . . . 0.0 112.493 177.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -75.22 -25.59 68.25 Favored Glycine 0 CA--C 1.53 1.003 0 O-C-N 121.133 -0.98 . . . . 0.0 112.916 -177.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 23.0 tp -50.75 -48.69 59.07 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 118.359 1.08 . . . . 0.0 109.333 166.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -68.31 -21.45 64.77 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.931 -168.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -69.31 -43.55 73.54 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 120.398 1.454 . . . . 0.0 111.565 172.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -60.34 -55.4 34.15 Favored 'General case' 0 CA--C 1.522 -0.098 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 175.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.8 mm -58.3 -33.28 47.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 123.609 0.763 . . . . 0.0 110.605 -176.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.9 -35.56 45.86 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 119.429 1.013 . . . . 0.0 112.219 175.668 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.26 -61.45 2.35 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 119.212 0.915 . . . . 0.0 109.365 176.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.417 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 10.2 t60 -57.98 -36.56 72.78 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.876 0.871 . . . . 0.0 112.194 -175.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 96.7 m -70.39 -54.37 12.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 118.358 -0.83 . . . . 0.0 110.973 175.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.14 -24.99 65.06 Favored 'General case' 0 C--O 1.23 0.074 0 CA-C-N 118.862 0.755 . . . . 0.0 112.03 -171.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.4 t -76.85 -15.37 59.73 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 118.653 -0.689 . . . . 0.0 110.755 178.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 83.6 mt -114.77 -58.28 2.16 Favored 'General case' 0 C--N 1.343 0.324 0 CA-C-N 119.636 1.107 . . . . 0.0 110.6 -174.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 149.36 5.55 0.22 Allowed Glycine 0 CA--C 1.528 0.901 0 CA-C-O 118.93 -0.928 . . . . 0.0 113.9 -173.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 30.3 m170 . . . . . 0 C--O 1.238 0.453 0 CA-C-N 119.511 1.656 . . . . 0.0 110.74 -161.558 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 1.2 m80 . . . . . 0 CA--C 1.532 0.256 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 81.6 mt -147.19 133.67 19.74 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 125.829 1.652 . . . . 0.0 108.102 -173.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 47.1 t-80 -67.6 -42.9 81.72 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 124.294 0.996 . . . . 0.0 111.807 179.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -170.2 -179.2 3.03 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.243 1.417 . . . . 0.0 109.157 -173.387 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 16.0 t -59.26 -40.62 81.71 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 C-N-CA 123.824 0.85 . . . . 0.0 110.818 -175.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -54.15 -45.67 72.08 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.875 0.87 . . . . 0.0 109.829 178.401 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -63.12 -41.53 99.36 Favored 'General case' 0 C--N 1.333 -0.115 0 C-N-CA 124.746 1.218 . . . . 0.0 110.564 -178.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.56 -50.17 74.63 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 124.224 1.01 . . . . 0.0 111.135 178.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 14.0 mm -66.31 -37.09 78.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -174.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -61.91 -47.97 82.54 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 118.763 0.711 . . . . 0.0 110.168 174.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -52.83 -63.7 1.06 Allowed 'General case' 0 C--N 1.342 0.257 0 C-N-CA 125.323 1.449 . . . . 0.0 111.59 179.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.7 mp -51.43 -47.0 63.15 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.702 1.201 . . . . 0.0 110.993 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -73.28 -18.36 61.22 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 121.663 -0.648 . . . . 0.0 112.377 -178.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -85.48 -22.85 28.05 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.357 1.063 . . . . 0.0 111.418 176.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 22.5 mt . . . . . 0 N--CA 1.453 -0.318 0 C-N-CA 124.133 0.973 . . . . 0.0 109.065 172.591 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 10.3 p . . . . . 0 CA--C 1.54 0.588 0 CA-C-O 119.227 -0.416 . . . . 0.0 110.771 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -79.31 90.2 1.29 Allowed 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 123.865 3.043 . . . . 0.0 110.258 -178.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 74.54 144.72 0.11 Allowed Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 127.898 2.479 . . . . 0.0 111.194 -175.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -77.94 -20.41 11.69 Favored 'Trans proline' 0 CA--C 1.535 0.534 0 C-N-CA 122.349 2.032 . . . . 0.0 113.507 -178.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -90.22 -15.89 30.51 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.256 0.622 . . . . 0.0 112.634 -175.088 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.8 tt -62.74 142.49 58.12 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 118.936 0.789 . . . . 0.0 109.806 170.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 18.2 mm -126.95 136.47 60.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 C-N-CA 124.194 0.998 . . . . 0.0 108.607 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 75.1 m95 -77.94 156.86 79.56 Favored Pre-proline 0 CA--C 1.543 0.693 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 -178.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -67.34 163.33 74.14 Favored 'Cis proline' 0 N--CA 1.458 -0.568 0 C-N-CA 124.633 -0.986 . . . . 0.0 113.355 -9.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -131.79 171.22 13.79 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.218 1.807 . . . . 0.0 110.016 176.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.7 mt -141.52 107.13 5.07 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 125.611 1.564 . . . . 0.0 107.63 -174.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.1 tp -84.14 151.27 24.99 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 169.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.472 ' HE3' ' O ' ' A' ' 22' ' ' CYS . 0.1 OUTLIER -142.58 91.5 2.32 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 171.894 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -48.31 136.0 12.92 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 124.522 1.139 . . . . 0.0 110.939 -168.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -66.28 91.5 0.17 Allowed 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 122.122 0.963 . . . . 0.0 111.808 -172.172 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 137.73 -40.43 1.49 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 124.942 1.258 . . . . 0.0 110.308 -178.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.472 ' O ' ' HE3' ' A' ' 18' ' ' LYS . 62.7 m -65.71 173.16 2.97 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 121.544 0.687 . . . . 0.0 110.281 177.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -122.04 -32.36 3.72 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 176.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -60.76 137.89 58.16 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 124.682 1.193 . . . . 0.0 108.417 170.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.4 mt -87.46 154.07 20.93 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 124.427 1.091 . . . . 0.0 108.987 168.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -111.91 86.72 7.71 Favored Pre-proline 0 CA--C 1.542 0.64 0 N-CA-C 105.847 -1.908 . . . . 0.0 105.847 175.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -60.56 140.74 92.81 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 123.936 3.091 . . . . 0.0 109.412 174.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.5 mt -132.89 96.69 3.84 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 106.654 -1.61 . . . . 0.0 106.654 -178.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.8 mtt-85 -53.7 -45.6 70.45 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 124.27 1.028 . . . . 0.0 110.882 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.4 t -157.19 178.14 10.68 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 -172.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -56.84 -34.65 67.97 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 123.716 0.807 . . . . 0.0 111.696 171.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -63.07 -17.74 62.61 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.539 1.063 . . . . 0.0 111.601 177.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -81.55 -44.71 16.93 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.689 1.596 . . . . 0.0 109.03 175.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 57.6 t-105 -57.72 -33.01 67.97 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.051 1.741 . . . . 0.0 112.481 174.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 -65.03 -50.25 66.96 Favored 'General case' 0 C--O 1.232 0.155 0 O-C-N 120.436 -1.415 . . . . 0.0 110.769 172.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 50.6 mtp85 . . . . . 0 C--O 1.227 -0.119 0 CA-C-O 117.207 -1.378 . . . . 0.0 112.091 -175.802 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 81.1 mt . . . . . 0 C--O 1.235 0.323 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -136.95 157.58 46.42 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 124.621 1.168 . . . . 0.0 109.545 -173.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -65.2 121.33 14.52 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 107.513 -1.291 . . . . 0.0 107.513 179.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 97.1 10.77 54.37 Favored Glycine 0 CA--C 1.535 1.299 0 CA-C-O 117.482 -1.732 . . . . 0.0 114.404 -177.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.3 -13.67 41.25 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-N 120.441 2.121 . . . . 0.0 115.466 178.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt 47.73 144.46 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.531 1 C-N-CA 134.815 5.246 . . . . 0.0 114.632 -176.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 14.8 mt -126.58 156.21 41.23 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 166.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 17.3 t -130.57 141.8 45.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 N-CA-C 104.552 -2.388 . . . . 0.0 104.552 163.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -98.66 179.78 4.56 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.276 1.03 . . . . 0.0 110.539 173.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.6 m -61.98 -3.09 1.07 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 115.881 1.808 . . . . 0.0 115.881 174.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 -120.79 16.2 11.84 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 127.04 2.136 . . . . 0.0 110.368 -176.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 65.33 13.94 9.11 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.819 2.048 . . . . 0.0 112.874 175.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 31.1 m170 -69.04 110.0 4.27 Favored 'General case' 0 C--N 1.329 -0.285 0 O-C-N 120.191 -1.568 . . . . 0.0 109.121 174.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -71.22 143.74 50.34 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 119.501 1.046 . . . . 0.0 108.76 167.524 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -135.65 159.49 41.47 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 125.397 1.479 . . . . 0.0 109.602 -179.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 30.3 t -141.64 141.33 30.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 C-N-CA 128.158 2.583 . . . . 0.0 105.961 -174.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 22.8 tp -94.42 132.73 38.76 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 128.299 2.64 . . . . 0.0 105.657 174.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 73.3 mt-10 -128.99 174.72 9.28 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.291 1.036 . . . . 0.0 112.11 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -68.38 -18.5 64.48 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 125.622 1.569 . . . . 0.0 114.516 -166.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -77.0 12.34 1.43 Allowed 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.067 1.347 . . . . 0.0 111.256 174.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 45.91 48.48 12.16 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 126.241 1.816 . . . . 0.0 109.693 -170.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -120.44 161.51 21.11 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.544 0.687 . . . . 0.0 110.876 162.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 81.6 m95 -94.75 154.56 17.23 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 106.043 -1.836 . . . . 0.0 106.043 158.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -142.46 161.34 50.45 Favored Pre-proline 0 CA--C 1.54 0.569 0 C-N-CA 123.935 0.894 . . . . 0.0 111.079 -176.02 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.04 134.42 27.35 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 124.313 3.342 . . . . 0.0 111.153 172.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -129.01 21.11 5.83 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.234 1.414 . . . . 0.0 112.833 -176.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 75.59 154.5 0.15 Allowed Pre-proline 0 CA--C 1.539 0.551 0 C-N-CA 131.479 3.912 . . . . 0.0 113.496 -177.22 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -72.0 163.58 38.34 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 121.756 1.638 . . . . 0.0 113.419 -176.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.4 tt -102.37 143.58 26.9 Favored Pre-proline 0 CA--C 1.545 0.762 0 C-N-CA 126.263 1.825 . . . . 0.0 109.273 -173.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -83.01 166.82 14.54 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 123.954 3.103 . . . . 0.0 111.706 -176.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -64.14 -21.27 67.84 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 121.626 1.551 . . . . 0.0 112.96 -175.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -90.34 -20.45 22.85 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.652 1.581 . . . . 0.0 112.928 175.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.02 -32.55 84.53 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-N 119.518 1.054 . . . . 0.0 111.104 -175.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 32.5 tp -59.67 -51.23 70.67 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.065 0.946 . . . . 0.0 108.511 178.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -61.28 -25.05 66.84 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.274 1.829 . . . . 0.0 111.061 178.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -76.43 -47.5 22.87 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.524 1.056 . . . . 0.0 111.029 176.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -61.2 -50.35 73.47 Favored 'General case' 0 CA--C 1.521 -0.16 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 177.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.7 mm -53.73 -42.24 50.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 C-N-CA 124.022 0.929 . . . . 0.0 109.672 -179.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.9 ttt85 -51.38 -38.57 54.01 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 120.017 1.28 . . . . 0.0 113.614 177.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.15 -49.64 75.06 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 119.774 1.17 . . . . 0.0 109.987 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 24.0 t60 -60.69 -46.0 92.05 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.863 0.865 . . . . 0.0 109.716 176.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 73.2 m -65.04 -34.47 78.51 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 118.297 -0.859 . . . . 0.0 111.886 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -71.45 -40.82 70.11 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 119.019 0.827 . . . . 0.0 111.122 -177.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 8.6 t -71.42 -35.04 70.82 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 118.989 -0.529 . . . . 0.0 110.187 -175.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 64.3 mt -78.42 -47.13 18.2 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 175.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 99.04 53.33 1.18 Allowed Glycine 0 CA--C 1.527 0.838 0 C-N-CA 127.247 2.356 . . . . 0.0 110.625 -178.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 35.3 m-70 . . . . . 0 CA--C 1.536 0.428 0 C-N-CA 126.118 1.767 . . . . 0.0 111.688 -177.913 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 8.5 m80 . . . . . 0 C--O 1.232 0.16 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 94.1 mt -145.5 154.41 42.18 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 126.205 1.802 . . . . 0.0 108.503 -165.05 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -96.41 -28.78 14.29 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.127 -0.488 . . . . 0.0 112.271 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.6 t -171.63 179.85 2.72 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.432 1.493 . . . . 0.0 108.508 -177.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 60.6 t -65.21 -37.09 79.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 O-C-N 121.325 -0.859 . . . . 0.0 110.989 -177.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 3.7 tpt -59.05 -38.56 79.65 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 121.916 -0.49 . . . . 0.0 109.919 177.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -63.73 -44.31 93.94 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 124.27 1.028 . . . . 0.0 109.166 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -55.67 -52.0 65.32 Favored 'General case' 0 C--N 1.34 0.195 0 C-N-CA 125.599 1.56 . . . . 0.0 112.404 -178.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 30.0 mm -61.98 -44.08 98.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 -175.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.68 -40.78 92.71 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.151 0.58 . . . . 0.0 110.418 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -55.28 -55.17 34.5 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 124.318 1.047 . . . . 0.0 109.686 176.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 6.8 mt -61.64 -45.57 93.48 Favored 'General case' 0 CA--C 1.517 -0.315 0 O-C-N 124.182 0.926 . . . . 0.0 110.679 -176.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 -59.35 -43.41 92.81 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 118.988 -0.53 . . . . 0.0 110.065 179.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.8 -12.76 61.86 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 -177.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 57.2 mt . . . . . 0 N--CA 1.465 0.3 0 CA-C-N 120.155 1.343 . . . . 0.0 109.162 177.254 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.236 0.381 0 CA-C-O 118.625 -0.703 . . . . 0.0 110.816 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -68.4 -54.66 0.28 Allowed 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.598 2.199 . . . . 0.0 111.931 176.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 20.3 t-80 -161.94 144.21 8.71 Favored Pre-proline 0 CA--C 1.536 0.427 0 CA-C-N 119.853 1.206 . . . . 0.0 108.661 174.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -73.64 -1.73 11.16 Favored 'Trans proline' 0 CA--C 1.536 0.609 0 C-N-CA 122.93 2.42 . . . . 0.0 114.216 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -113.11 -3.93 13.89 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.743 1.217 . . . . 0.0 112.23 177.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.7 tt -66.77 117.02 8.31 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 163.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 29.4 mm -100.05 103.9 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 177.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 71.9 m95 -53.47 150.51 12.28 Favored Pre-proline 0 CA--C 1.533 0.292 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.761 176.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -68.88 167.91 66.2 Favored 'Cis proline' 0 N--CA 1.456 -0.696 0 N-CA-C 114.878 1.069 . . . . 0.0 114.878 -0.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -139.23 167.78 21.3 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 124.831 1.252 . . . . 0.0 110.741 -179.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.5 mt -140.53 114.32 8.9 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 125.734 1.613 . . . . 0.0 108.488 -172.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.7 tp -95.7 143.77 26.67 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.602 1.561 . . . . 0.0 109.015 178.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -146.21 98.05 3.03 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 119.616 1.098 . . . . 0.0 110.769 175.485 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -58.87 160.31 5.99 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-O 122.687 1.232 . . . . 0.0 112.658 -173.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -76.12 99.87 4.8 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 122.63 1.205 . . . . 0.0 111.981 174.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 126.89 -39.43 1.97 Allowed Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 126.229 1.871 . . . . 0.0 108.506 169.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 41.6 m -65.67 165.07 13.18 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 124.568 1.147 . . . . 0.0 109.647 174.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 -122.16 -28.16 4.42 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 124.914 1.286 . . . . 0.0 109.539 -178.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -60.82 115.11 3.43 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 127.825 2.45 . . . . 0.0 109.177 -178.048 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -72.4 147.61 46.04 Favored 'General case' 0 N--CA 1.463 0.197 0 O-C-N 121.103 -0.998 . . . . 0.0 109.496 172.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.06 87.61 9.08 Favored Pre-proline 0 CA--C 1.535 0.369 0 C-N-CA 125.48 1.512 . . . . 0.0 108.945 176.084 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -63.48 127.54 20.15 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 122.641 2.227 . . . . 0.0 110.73 172.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -114.72 107.75 15.87 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 125.996 1.718 . . . . 0.0 107.604 169.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.7 mtt-85 -61.85 -45.79 92.29 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.045 0.384 . . . . 0.0 111.186 -178.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 13.3 t -146.85 -176.1 5.07 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 121.918 0.866 . . . . 0.0 110.54 174.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -54.44 -38.35 66.21 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 124.789 1.236 . . . . 0.0 110.085 -179.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.73 -19.85 63.54 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 121.423 0.63 . . . . 0.0 111.498 -177.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -78.47 -35.12 47.05 Favored 'General case' 0 CA--C 1.521 -0.164 0 O-C-N 120.151 -1.593 . . . . 0.0 109.923 175.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 49.9 t-105 -64.03 -34.93 79.12 Favored 'General case' 0 C--O 1.234 0.266 0 O-C-N 121.455 -0.778 . . . . 0.0 110.615 170.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -57.5 -57.15 13.96 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-O 118.834 -0.603 . . . . 0.0 109.771 168.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.552 1.025 0 C-N-CA 117.543 -1.663 . . . . 0.0 109.632 -168.499 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 57.9 mt . . . . . 0 N--CA 1.454 -0.243 0 N-CA-C 107.646 -1.242 . . . . 0.0 107.646 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -129.7 147.21 51.46 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.656 1.582 . . . . 0.0 107.943 -177.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.414 ' CD1' HD12 ' A' ' 61' ' ' LEU . 40.3 m-85 -67.16 91.32 0.22 Allowed 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 124.858 1.263 . . . . 0.0 110.629 -167.435 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 140.48 15.93 0.48 Allowed Glycine 0 CA--C 1.528 0.889 0 C-N-CA 124.203 0.906 . . . . 0.0 113.336 -179.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.13 -9.97 0.74 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 127.768 2.427 . . . . 0.0 115.321 171.779 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.2 ttmt 44.42 115.69 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 130.808 3.643 . . . . 0.0 113.737 175.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 16.1 mt -104.42 155.19 19.0 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 167.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 23.7 t -136.81 142.94 36.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 N-CA-C 105.952 -1.87 . . . . 0.0 105.952 160.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.406 ' CG ' ' H ' ' A' ' 55' ' ' ASN . 0.9 OUTLIER -104.68 -170.56 1.78 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.829 1.652 . . . . 0.0 111.018 179.126 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.6 m -72.55 -15.69 61.76 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 176.499 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.406 ' H ' ' CG ' ' A' ' 53' ' ' ASP . 21.6 m-80 -80.14 -3.95 50.93 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.829 1.251 . . . . 0.0 112.469 168.337 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 63.88 19.49 11.76 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.521 1.128 . . . . 0.0 109.88 -170.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 66.6 m170 -67.06 107.44 2.28 Favored 'General case' 0 CA--C 1.518 -0.266 0 O-C-N 120.215 -1.553 . . . . 0.0 106.918 170.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -74.04 153.86 39.49 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 121.952 0.882 . . . . 0.0 109.577 168.552 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -135.4 167.95 20.11 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 125.784 1.633 . . . . 0.0 108.511 -178.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 53.4 t -145.21 142.01 22.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 104.772 -2.307 . . . . 0.0 104.772 172.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.414 HD12 ' CD1' ' A' ' 47' ' ' TYR . 0.1 OUTLIER -81.6 124.53 29.62 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 106.379 -1.712 . . . . 0.0 106.379 170.461 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -109.21 161.25 15.41 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 118.516 0.598 . . . . 0.0 109.533 -178.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -55.84 -14.84 2.63 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -175.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.93 -11.04 57.98 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.937 1.295 . . . . 0.0 112.78 170.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 74.45 8.16 4.49 Favored 'General case' 0 C--N 1.351 0.643 0 C-N-CA 126.236 1.815 . . . . 0.0 111.193 -165.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -94.26 164.35 13.07 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 118.783 0.72 . . . . 0.0 111.403 177.081 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -107.96 107.28 17.91 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 107.645 -1.242 . . . . 0.0 107.645 173.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 -79.98 143.58 57.72 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -71.78 105.27 1.76 Allowed 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 124.606 3.537 . . . . 0.0 109.815 170.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.92 28.69 0.09 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.061 1.344 . . . . 0.0 111.559 170.026 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 67.8 166.71 0.12 Allowed Pre-proline 0 CA--C 1.539 0.53 0 C-N-CA 125.79 1.636 . . . . 0.0 111.602 -178.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -64.36 162.88 28.62 Favored 'Trans proline' 0 N--CA 1.45 -1.052 0 C-N-CA 120.47 0.78 . . . . 0.0 110.925 168.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 20.7 tp -122.67 144.63 43.01 Favored Pre-proline 0 N--CA 1.448 -0.575 0 C-N-CA 126.717 2.007 . . . . 0.0 106.262 -178.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -62.24 160.68 29.8 Favored 'Trans proline' 0 N--CA 1.453 -0.91 0 C-N-CA 121.608 1.538 . . . . 0.0 110.445 174.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -59.97 -25.12 78.72 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 122.28 1.987 . . . . 0.0 112.487 179.168 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -89.2 -20.04 24.68 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 126.549 1.94 . . . . 0.0 109.764 -174.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.06 -23.17 78.37 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 123.814 0.721 . . . . 0.0 112.432 176.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 27.9 tp -55.66 -46.99 77.42 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.311 1.044 . . . . 0.0 109.847 169.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . 0.49 ' ND2' ' HD1' ' A' ' 98' ' ' HIS . 1.6 m120 -58.45 -26.17 63.03 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.452 1.501 . . . . 0.0 111.379 -175.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -74.79 -24.35 58.64 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.18 1.392 . . . . 0.0 113.158 177.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 93.7 mt -84.94 -53.56 5.23 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 175.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.7 mm -56.74 -28.06 27.11 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 125.395 1.478 . . . . 0.0 110.258 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -44.14 -46.45 8.75 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 125.581 1.552 . . . . 0.0 111.172 174.418 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.73 -48.77 77.77 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 123.525 0.73 . . . . 0.0 111.718 -176.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 13.0 t60 -59.32 -46.62 88.11 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.368 0.667 . . . . 0.0 109.716 177.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 78.2 m -68.92 -31.99 71.28 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 120.896 -1.127 . . . . 0.0 111.129 -178.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -80.63 -12.51 59.49 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 125.111 1.365 . . . . 0.0 113.557 -179.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.0 t -95.57 -4.41 44.7 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.107 0.867 . . . . 0.0 110.981 170.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 88.9 mt -122.72 -46.84 2.1 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 119.89 1.223 . . . . 0.0 111.66 -174.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 119.95 57.59 0.25 Allowed Glycine 0 CA--C 1.528 0.891 0 C-N-CA 125.239 1.399 . . . . 0.0 112.529 178.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.47 0.556 0 CA-C-N 118.975 1.388 . . . . 0.0 112.674 -179.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . 0.49 ' HD1' ' ND2' ' A' ' 79' ' ' ASN . 17.2 t-160 . . . . . 0 CA--C 1.519 -0.245 0 CA-C-O 119.244 -0.408 . . . . 0.0 111.86 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 84.2 mt -138.85 146.76 41.6 Favored 'General case' 0 CA--C 1.514 -0.43 0 C-N-CA 124.647 1.179 . . . . 0.0 107.907 169.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 -79.45 -36.31 39.06 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 124.557 1.143 . . . . 0.0 112.539 -179.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 24.2 p -170.64 174.0 5.19 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 126.18 1.792 . . . . 0.0 108.625 -177.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 68.7 t -62.62 -45.74 98.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-O 118.714 -0.66 . . . . 0.0 109.929 177.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 46.8 tpp -62.77 -46.05 89.82 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.843 1.201 . . . . 0.0 110.155 -177.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.29 -35.44 69.8 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 178.459 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.42 -41.77 98.94 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 123.652 0.781 . . . . 0.0 112.492 174.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 29.1 mm -56.02 -49.99 72.33 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-N 119.364 0.984 . . . . 0.0 108.889 -177.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.67 -40.73 63.47 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.123 -176.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -50.29 -59.16 4.24 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.535 0.734 . . . . 0.0 111.454 173.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 74.4 mt -58.29 -35.57 72.0 Favored 'General case' 0 CA--C 1.522 -0.125 0 C-N-CA 125.289 1.436 . . . . 0.0 112.159 -174.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -69.16 -46.12 68.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 119.227 -0.416 . . . . 0.0 110.355 174.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -69.61 -11.65 61.01 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.132 0.973 . . . . 0.0 112.829 -178.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 19.8 mt . . . . . 0 N--CA 1.454 -0.263 0 CA-C-N 119.279 0.945 . . . . 0.0 110.687 169.849 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 14.2 p . . . . . 0 C--O 1.239 0.519 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -97.47 84.06 0.07 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.173 0 C-N-CA 122.61 2.207 . . . . 0.0 110.588 -177.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 75.4 143.66 0.1 OUTLIER Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 128.91 2.884 . . . . 0.0 110.455 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -84.11 -15.89 6.47 Favored 'Trans proline' 0 CA--C 1.535 0.548 0 C-N-CA 122.921 2.414 . . . . 0.0 112.21 175.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.434 HE22 ' CE1' ' A' ' 57' ' ' HIS . 0.0 OUTLIER -76.9 -13.52 59.98 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.736 0.814 . . . . 0.0 110.559 175.74 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 tt -68.43 130.97 44.46 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-N 118.385 0.539 . . . . 0.0 110.542 169.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 8.0 mm -119.08 102.55 13.16 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 126.602 1.961 . . . . 0.0 108.258 -179.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 84.5 m95 -58.84 148.83 67.42 Favored Pre-proline 0 CA--C 1.54 0.566 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 -175.327 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.99 172.45 56.93 Favored 'Cis proline' 0 N--CA 1.455 -0.776 0 N-CA-C 114.271 0.835 . . . . 0.0 114.271 5.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.17 166.11 25.96 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.306 172.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.9 mt -132.91 105.97 7.42 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 125.29 1.436 . . . . 0.0 107.333 -178.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 29.9 tp -66.9 142.03 57.44 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 171.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.14 94.53 2.54 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 107.47 -1.307 . . . . 0.0 107.47 165.365 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -59.32 155.9 13.7 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 126.013 1.725 . . . . 0.0 110.145 -173.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -63.79 116.47 5.78 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 127.453 2.301 . . . . 0.0 109.726 -173.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 79.9 -11.22 35.79 Favored Glycine 0 CA--C 1.528 0.898 0 CA-C-O 118.523 -1.154 . . . . 0.0 113.516 178.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 50.7 m -72.05 178.14 3.96 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.644 1.722 . . . . 0.0 109.688 167.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -142.47 -22.13 0.67 Allowed 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 125.166 1.386 . . . . 0.0 111.704 -178.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.49 148.14 49.92 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 166.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -104.96 150.09 25.2 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 170.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -106.75 88.54 3.58 Favored Pre-proline 0 C--O 1.234 0.254 0 C-N-CA 126.923 2.089 . . . . 0.0 110.883 175.372 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -56.82 131.32 44.85 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.579 2.186 . . . . 0.0 110.337 177.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -123.55 97.63 5.47 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 125.91 1.684 . . . . 0.0 107.477 172.09 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.5 mtt85 -56.18 -45.54 79.71 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 118.584 0.629 . . . . 0.0 110.939 177.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 12.3 t -148.82 -175.6 5.01 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 121.737 0.779 . . . . 0.0 110.054 173.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -54.12 -34.58 60.66 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.176 1.39 . . . . 0.0 111.61 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -61.22 -41.23 96.48 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.216 0.532 . . . . 0.0 109.878 178.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -70.49 -27.87 64.54 Favored 'General case' 0 C--O 1.232 0.141 0 C-N-CA 125.471 1.508 . . . . 0.0 110.639 -177.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 42.5 t-105 -68.08 -50.97 51.67 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.989 0.916 . . . . 0.0 110.242 166.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -58.76 -38.9 79.48 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 118.723 0.692 . . . . 0.0 110.115 -177.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 63.6 mtt180 . . . . . 0 N--CA 1.471 0.583 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 177.052 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 92.8 mt . . . . . 0 N--CA 1.448 -0.538 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -122.07 156.39 33.67 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.752 1.221 . . . . 0.0 109.265 -167.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.469 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 14.8 m-85 -68.59 96.18 0.69 Allowed 'General case' 0 C--O 1.233 0.236 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 174.298 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 131.31 7.61 3.13 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 124.153 0.883 . . . . 0.0 113.516 -176.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.43 -20.56 55.98 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 116.142 1.905 . . . . 0.0 116.142 -168.39 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt 44.59 128.54 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 130.784 3.634 . . . . 0.0 118.572 171.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 5.3 mt -127.86 151.98 48.39 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 124.605 1.162 . . . . 0.0 109.079 178.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 81.6 t -127.03 142.11 44.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 N-CA-C 104.959 -2.237 . . . . 0.0 104.959 163.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 14.3 p-10 -107.56 176.51 5.13 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 124.736 1.214 . . . . 0.0 110.872 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.23 -11.31 30.01 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.103 0.961 . . . . 0.0 112.846 -179.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -99.83 6.05 45.4 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.475 1.51 . . . . 0.0 110.37 179.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 66.25 18.32 10.9 Favored 'General case' 0 C--N 1.344 0.36 0 C-N-CA 127.158 2.183 . . . . 0.0 112.075 -178.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.434 ' CE1' HE22 ' A' ' 10' ' ' GLN . 22.5 m170 -75.31 117.28 16.95 Favored 'General case' 0 N--CA 1.443 -0.803 0 O-C-N 120.99 -1.069 . . . . 0.0 108.892 175.525 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 57.1 m -75.49 138.02 41.3 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 169.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -143.5 158.0 44.0 Favored 'General case' 0 C--N 1.334 -0.105 0 C-N-CA 126.244 1.817 . . . . 0.0 111.071 177.442 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.412 ' HA ' ' CZ3' ' A' ' 67' ' ' TRP . 4.1 p -152.45 151.21 12.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 168.097 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 34.3 tp -69.38 132.7 46.8 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 127.176 2.19 . . . . 0.0 109.41 173.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -113.51 174.98 5.65 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.973 1.309 . . . . 0.0 109.399 178.053 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.469 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 28.4 mt-10 -64.31 -20.49 66.12 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 125.715 1.606 . . . . 0.0 113.146 -177.386 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -82.0 6.08 17.23 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.416 1.487 . . . . 0.0 111.612 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 68.03 -4.52 1.01 Allowed 'General case' 0 C--O 1.237 0.404 0 C-N-CA 128.874 2.87 . . . . 0.0 113.931 -175.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -77.49 168.3 20.23 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 119.378 0.99 . . . . 0.0 111.959 172.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.412 ' CZ3' ' HA ' ' A' ' 60' ' ' VAL . 22.2 m95 -107.99 144.02 35.86 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 107.407 -1.331 . . . . 0.0 107.407 166.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -134.22 151.73 76.96 Favored Pre-proline 0 C--N 1.331 -0.235 0 C-N-CA 124.557 1.143 . . . . 0.0 111.626 -167.729 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -74.71 146.95 34.62 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 124.026 3.151 . . . . 0.0 112.607 -172.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -135.07 36.49 3.03 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.205 1.402 . . . . 0.0 111.927 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 70.99 166.4 0.13 Allowed Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 126.519 1.928 . . . . 0.0 111.896 -177.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.02 176.38 9.99 Favored 'Trans proline' 0 CA--C 1.535 0.543 0 C-N-CA 121.386 1.39 . . . . 0.0 111.269 170.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 14.5 tp -120.77 151.35 54.41 Favored Pre-proline 0 CA--C 1.543 0.675 0 C-N-CA 125.17 1.388 . . . . 0.0 110.234 -176.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -73.27 163.16 38.66 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.837 2.358 . . . . 0.0 111.171 168.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.0 -25.17 23.17 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 122.423 2.082 . . . . 0.0 112.879 179.104 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -83.36 -19.03 36.86 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 119.132 0.878 . . . . 0.0 110.636 176.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.69 -18.2 51.7 Favored Glycine 0 CA--C 1.532 1.111 0 N-CA-C 111.269 -0.733 . . . . 0.0 111.269 171.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 40.3 tp -60.0 -54.06 50.47 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 124.836 1.254 . . . . 0.0 108.429 170.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . 0.442 HD21 ' CG ' ' A' ' 98' ' ' HIS . 5.9 m120 -62.73 -24.64 67.78 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 125.501 1.521 . . . . 0.0 112.239 179.556 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 -66.91 -45.4 78.06 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 120.393 1.451 . . . . 0.0 109.874 172.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -67.62 -54.98 15.18 Favored 'General case' 0 C--O 1.231 0.111 0 N-CA-C 108.218 -1.031 . . . . 0.0 108.218 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 12.2 mm -55.7 -32.22 30.95 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 125.165 1.386 . . . . 0.0 110.961 -178.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.81 -57.04 4.63 Favored 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 124.259 1.023 . . . . 0.0 111.447 175.325 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -70.5 -34.87 72.82 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 120.341 -0.543 . . . . 0.0 111.58 -170.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 28.5 t60 -60.67 -53.16 60.85 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.661 0.784 . . . . 0.0 109.852 175.442 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 99.6 m -63.8 -37.91 89.15 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 118.296 -0.859 . . . . 0.0 110.484 179.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.06 -36.49 77.73 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 119.242 0.928 . . . . 0.0 112.402 -179.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 13.1 t -70.06 -32.82 71.11 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.886 0.766 . . . . 0.0 110.479 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 63.8 mt -80.03 -56.59 4.14 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.721 0.808 . . . . 0.0 109.682 177.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 135.19 7.83 1.91 Allowed Glycine 0 CA--C 1.539 1.548 0 C-N-CA 126.004 1.764 . . . . 0.0 114.055 -175.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 39.3 m-70 . . . . . 0 C--O 1.237 0.401 0 CA-C-N 119.956 1.878 . . . . 0.0 110.488 -179.872 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . 0.442 ' CG ' HD21 ' A' ' 79' ' ' ASN . 58.8 m80 . . . . . 0 CA--C 1.54 0.584 0 N-CA-C 112.84 0.681 . . . . 0.0 112.84 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 43.1 mt -148.07 128.89 14.31 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 127.567 2.347 . . . . 0.0 106.309 -160.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -66.57 -46.24 76.68 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.924 0.393 . . . . 0.0 110.331 -176.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 74.3 m -153.72 174.04 15.05 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.264 1.426 . . . . 0.0 110.292 -171.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 38.8 t -50.41 -39.74 17.52 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 C-N-CA 126.799 2.04 . . . . 0.0 109.496 173.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 20.9 tpp -57.1 -40.03 76.22 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 124.186 0.994 . . . . 0.0 113.386 177.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -69.89 -42.1 73.86 Favored 'General case' 0 N--CA 1.463 0.177 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 177.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.74 -45.6 91.97 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.785 1.234 . . . . 0.0 112.381 -172.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 11.0 mm -58.05 -43.9 86.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -66.85 -46.43 75.1 Favored 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 124.154 0.981 . . . . 0.0 110.411 -178.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 36.1 t80 -53.71 -61.48 2.27 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 125.516 1.526 . . . . 0.0 110.063 177.391 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 7.2 mp -50.34 -46.76 55.92 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.154 1.382 . . . . 0.0 112.384 175.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -63.0 -36.77 84.66 Favored 'General case' 0 C--N 1.333 -0.142 0 O-C-N 123.323 0.39 . . . . 0.0 111.591 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -74.86 -26.13 59.46 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 118.542 -0.742 . . . . 0.0 111.584 179.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 29.2 mt . . . . . 0 N--CA 1.465 0.278 0 C-N-CA 124.043 0.937 . . . . 0.0 109.358 -177.331 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.446 -0.627 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.24 -55.04 0.07 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.207 0 C-N-CA 121.756 1.637 . . . . 0.0 110.883 177.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 19.0 t-80 -150.56 147.41 21.36 Favored Pre-proline 0 CA--C 1.534 0.338 0 C-N-CA 125.732 1.613 . . . . 0.0 107.708 -178.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -69.11 -38.62 8.94 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 122.795 2.33 . . . . 0.0 111.885 176.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.29 -17.58 61.86 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 117.901 -1.047 . . . . 0.0 112.255 -176.167 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.9 tt -58.74 122.6 13.93 Favored 'General case' 0 C--N 1.346 0.425 0 CA-C-N 118.692 0.678 . . . . 0.0 109.315 170.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.402 ' CG1' HD22 ' A' ' 55' ' ' ASN . 43.6 mm -109.95 117.43 54.66 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.257 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 176.28 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -55.17 152.51 14.88 Favored Pre-proline 0 CA--C 1.534 0.335 0 C-N-CA 123.841 0.856 . . . . 0.0 111.114 174.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -73.38 174.27 51.24 Favored 'Cis proline' 0 CA--C 1.535 0.541 0 C-N-CA 125.204 -0.749 . . . . 0.0 112.792 -0.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -138.55 173.06 11.99 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 121.234 0.54 . . . . 0.0 111.887 177.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 18.8 mt -139.78 110.38 6.71 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 126.014 1.725 . . . . 0.0 109.301 -175.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.8 tp -87.2 150.81 23.68 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.365 1.066 . . . . 0.0 108.303 167.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.13 84.84 2.06 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 119.895 1.225 . . . . 0.0 108.621 170.241 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.458 ' NE2' HE21 ' A' ' 46' ' ' GLN . 0.1 OUTLIER -52.41 134.15 34.63 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 122.815 0.446 . . . . 0.0 111.273 -168.84 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -64.27 125.94 26.18 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.13 -0.941 . . . . 0.0 108.909 -168.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 98.29 -19.99 52.29 Favored Glycine 0 CA--C 1.527 0.815 0 CA-C-O 118.241 -1.311 . . . . 0.0 112.168 -178.405 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 2.3 t -88.85 -177.09 5.42 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 119.423 1.612 . . . . 0.0 109.989 174.263 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.1 m-80 -127.66 -12.66 5.44 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 124.644 1.178 . . . . 0.0 110.105 170.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -76.13 126.73 31.53 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 -176.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -75.51 147.32 39.85 Favored 'General case' 0 CA--C 1.52 -0.207 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 168.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -108.6 87.26 4.17 Favored Pre-proline 0 CA--C 1.537 0.453 0 C-N-CA 126.309 1.844 . . . . 0.0 109.081 175.057 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -66.32 113.09 2.53 Favored 'Trans proline' 0 N--CA 1.46 -0.496 0 C-N-CA 123.499 2.799 . . . . 0.0 109.901 177.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.2 mt -112.18 107.84 16.87 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 -177.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -51.65 -47.77 63.62 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 126.478 1.911 . . . . 0.0 111.587 -176.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.3 t -163.91 -179.25 6.16 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-O 121.949 0.88 . . . . 0.0 108.721 -168.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -68.33 -21.94 64.72 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 115.106 -0.952 . . . . 0.0 112.387 -175.384 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -69.85 -35.39 74.69 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 123.631 0.772 . . . . 0.0 110.626 169.224 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.8 t0 -67.03 -41.32 86.81 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 123.661 0.784 . . . . 0.0 109.423 177.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 75.5 t-105 -54.01 -41.06 67.57 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 121.536 -0.727 . . . . 0.0 111.193 172.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -71.91 -37.13 70.13 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 118.466 -0.778 . . . . 0.0 111.574 176.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.221 -0.436 0 CA-C-N 119.485 1.039 . . . . 0.0 109.972 172.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.1 mt . . . . . 0 C--O 1.235 0.314 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.458 HE21 ' NE2' ' A' ' 19' ' ' GLN . 21.8 pt20 -140.33 163.06 33.79 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.315 1.046 . . . . 0.0 110.987 -174.759 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -76.19 70.92 2.88 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.622 1.169 . . . . 0.0 110.959 -171.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 152.03 18.18 0.06 OUTLIER Glycine 0 CA--C 1.524 0.6 0 CA-C-O 118.908 -0.94 . . . . 0.0 114.433 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -71.22 -17.04 62.53 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.305 1.442 . . . . 0.0 113.437 179.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 52.25 154.91 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 129.869 3.267 . . . . 0.0 113.454 -174.302 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.7 tp -136.73 151.62 49.43 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 106.156 -1.794 . . . . 0.0 106.156 169.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 39.8 t -134.46 141.03 44.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 105.359 -2.089 . . . . 0.0 105.359 163.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -106.15 -178.67 3.72 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.077 1.351 . . . . 0.0 111.422 176.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.3 t -58.75 -24.39 61.55 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.271 1.428 . . . . 0.0 112.62 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.402 HD22 ' CG1' ' A' ' 12' ' ' ILE . 47.5 m-80 -90.23 1.04 56.9 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 124.498 1.119 . . . . 0.0 111.618 -179.741 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 65.93 24.05 11.22 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.519 1.128 . . . . 0.0 111.254 -173.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 24.3 m170 -69.11 108.52 3.61 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 164.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 92.8 m -70.81 153.35 42.83 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 121.702 0.763 . . . . 0.0 109.055 164.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -142.86 156.33 44.91 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.334 1.454 . . . . 0.0 108.157 170.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 25.7 t -135.19 144.69 33.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 C-N-CA 125.667 1.587 . . . . 0.0 107.78 166.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 11.9 tp -75.29 129.76 37.95 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 128.859 2.864 . . . . 0.0 106.872 175.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -120.91 170.55 9.38 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -178.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -61.09 -23.52 65.55 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 123.762 0.825 . . . . 0.0 112.161 -175.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -74.97 4.14 7.11 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.613 1.565 . . . . 0.0 112.341 176.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 58.56 21.77 9.01 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 128.419 2.687 . . . . 0.0 113.517 175.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -101.65 170.54 8.11 Favored 'General case' 0 C--O 1.232 0.17 0 C-N-CA 123.971 0.908 . . . . 0.0 110.259 163.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 62.2 m95 -103.16 95.47 6.14 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 171.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 60.5 t60 -69.13 144.51 95.38 Favored Pre-proline 0 CA--C 1.54 0.572 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 178.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -69.82 106.48 1.68 Allowed 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 123.788 2.992 . . . . 0.0 111.386 178.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -81.51 37.28 0.45 Allowed 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.59 1.556 . . . . 0.0 111.895 -177.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 69.79 165.05 0.13 Allowed Pre-proline 0 CA--C 1.541 0.611 0 C-N-CA 128.364 2.666 . . . . 0.0 112.751 -173.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -74.44 168.23 25.3 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 121.336 1.357 . . . . 0.0 110.06 166.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 21.6 tp -121.33 144.3 39.6 Favored Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 124.622 1.169 . . . . 0.0 108.817 -176.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.89 167.48 27.11 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.708 2.272 . . . . 0.0 110.76 172.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -66.46 -35.09 31.78 Favored 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 120.791 0.994 . . . . 0.0 111.491 -175.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -67.48 -27.11 66.74 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.886 1.274 . . . . 0.0 110.731 174.119 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -69.49 -29.61 71.5 Favored Glycine 0 N--CA 1.444 -0.788 0 CA-C-O 119.351 -0.694 . . . . 0.0 111.655 -173.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 21.1 tp -51.52 -47.42 63.33 Favored 'General case' 0 C--N 1.342 0.251 0 CA-C-N 117.683 0.741 . . . . 0.0 110.158 170.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -58.62 -30.64 67.42 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-O 117.259 -1.353 . . . . 0.0 111.384 -173.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 60.8 m-20 -57.68 -37.06 72.8 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 120.302 1.41 . . . . 0.0 111.279 176.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -71.42 -62.14 1.52 Allowed 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 -178.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 15.9 mm -59.47 -28.12 38.99 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 122.991 0.517 . . . . 0.0 111.671 -174.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.5 mtm180 -48.65 -40.59 28.44 Favored 'General case' 0 C--N 1.338 0.096 0 C-N-CA 124.924 1.29 . . . . 0.0 111.619 171.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.48 -61.41 2.46 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.446 1.098 . . . . 0.0 110.441 177.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -52.32 -43.89 64.8 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 125.514 1.526 . . . . 0.0 110.015 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 93.8 m -68.48 -43.62 76.56 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 121.588 -0.695 . . . . 0.0 111.86 179.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.11 -39.18 92.74 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 118.812 0.733 . . . . 0.0 111.246 -174.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 12.4 t -69.33 -11.74 61.07 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 118.189 -0.91 . . . . 0.0 111.791 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 67.2 mt -125.78 -4.44 7.03 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.71 1.604 . . . . 0.0 113.231 -176.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 73.75 20.91 79.8 Favored Glycine 0 CA--C 1.536 1.402 0 O-C-N 120.403 -1.436 . . . . 0.0 114.501 -178.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 10.1 m-70 . . . . . 0 C--O 1.243 0.719 0 CA-C-N 119.951 1.876 . . . . 0.0 112.476 -172.67 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 . . . . . 0 CA--C 1.539 0.525 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.442 ' H ' HD23 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -111.24 115.25 29.03 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 126.583 1.953 . . . . 0.0 109.388 172.514 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 10.7 t-160 -58.65 -28.99 66.21 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 172.314 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 18.6 m -148.86 165.15 32.37 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.458 -0.776 . . . . 0.0 110.229 -172.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 40.6 t -63.11 -35.72 72.94 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 O-C-N 121.65 -0.657 . . . . 0.0 109.873 179.314 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -40.65 88.54 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 126.495 1.918 . . . . 0.0 111.233 175.464 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.59 -51.02 71.19 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 178.655 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.12 -50.91 71.82 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.057 1.343 . . . . 0.0 112.794 -176.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 33.9 mm -55.87 -47.92 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 CA-C-N 119.938 1.245 . . . . 0.0 109.041 -175.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -69.66 -40.76 76.24 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 123.954 0.902 . . . . 0.0 110.105 -172.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -52.17 -67.08 0.28 Allowed 'General case' 0 C--O 1.224 -0.237 0 C-N-CA 125.224 1.41 . . . . 0.0 109.633 171.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 7.7 mp -45.45 -45.97 13.26 Favored 'General case' 0 C--N 1.345 0.383 0 C-N-CA 124.498 1.119 . . . . 0.0 112.08 175.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -62.64 -39.92 95.38 Favored 'General case' 0 C--N 1.334 -0.079 0 CA-C-O 119.207 -0.425 . . . . 0.0 112.031 -178.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -85.7 -11.25 54.18 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 118.531 0.605 . . . . 0.0 112.497 -176.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 45.4 mt . . . . . 0 CA--C 1.517 -0.302 0 CA-C-N 118.932 0.787 . . . . 0.0 110.082 173.955 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.542 0.651 0 N-CA-C 111.558 0.207 . . . . 0.0 111.558 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -83.6 80.3 2.54 Favored 'Trans proline' 0 N--CA 1.448 -1.179 0 C-N-CA 122.837 2.358 . . . . 0.0 109.204 -175.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 75.33 149.69 0.13 Allowed Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 127.12 2.168 . . . . 0.0 110.917 -176.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -93.26 -18.77 0.56 Allowed 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 122.751 2.3 . . . . 0.0 112.572 174.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.83 -18.58 65.45 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 119.162 0.892 . . . . 0.0 110.37 169.725 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 tt -67.58 132.01 46.73 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.321 0.648 . . . . 0.0 110.683 169.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 40.1 mm -120.87 99.97 8.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 C-N-CA 126.822 2.049 . . . . 0.0 108.398 -174.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -50.06 151.16 3.63 Favored Pre-proline 0 C--O 1.235 0.335 0 C-N-CA 124.059 0.944 . . . . 0.0 112.621 179.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -70.48 165.49 78.56 Favored 'Cis proline' 0 CA--C 1.532 0.387 0 O-C-N 122.982 0.99 . . . . 0.0 112.754 1.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -140.11 172.11 13.23 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.328 0.585 . . . . 0.0 111.809 176.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 14.7 mt -140.36 105.83 5.08 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 127.072 2.149 . . . . 0.0 107.498 -171.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 25.9 tp -77.72 152.85 33.47 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 167.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.19 84.75 1.71 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.959 1.254 . . . . 0.0 113.426 176.343 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -44.89 144.59 1.14 Allowed 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 116.012 1.856 . . . . 0.0 116.012 -166.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -76.67 85.63 3.32 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 124.981 1.312 . . . . 0.0 109.681 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 138.21 -34.85 2.09 Favored Glycine 0 CA--C 1.524 0.643 0 C-N-CA 126.426 1.965 . . . . 0.0 110.988 175.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -83.38 -20.68 33.78 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 118.371 -0.823 . . . . 0.0 113.092 -163.187 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 12.8 m-80 71.64 -21.43 0.21 Allowed 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 126.811 2.044 . . . . 0.0 112.511 -179.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -65.47 150.38 48.45 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 125.791 1.636 . . . . 0.0 111.56 173.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.2 mt -107.22 153.47 22.64 Favored 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 126.141 1.776 . . . . 0.0 109.013 171.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -118.57 86.87 30.07 Favored Pre-proline 0 CA--C 1.537 0.447 0 C-N-CA 124.992 1.317 . . . . 0.0 109.557 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -65.08 128.18 20.06 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 123.483 2.788 . . . . 0.0 110.338 178.126 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.2 mt -134.36 113.93 12.42 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 -177.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 4.1 mtt85 -64.64 -46.71 81.38 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.849 0.86 . . . . 0.0 112.419 -169.351 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.537 ' H ' ' HB2' ' A' ' 33' ' ' ASP . 43.1 p -141.48 -179.92 6.43 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.931 1.293 . . . . 0.0 109.738 -178.432 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -53.62 -36.36 61.92 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 123.705 0.802 . . . . 0.0 110.752 167.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -65.98 -30.22 70.74 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 123.241 0.616 . . . . 0.0 110.84 -179.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.537 ' HB2' ' H ' ' A' ' 30' ' ' THR . 0.3 OUTLIER -70.79 -41.22 71.93 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 123.621 0.769 . . . . 0.0 109.892 174.961 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 67.6 t-105 -60.72 -42.82 98.03 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 110.5 -0.185 . . . . 0.0 110.5 173.44 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -59.42 -38.37 80.47 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 121.175 -0.953 . . . . 0.0 110.982 174.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.227 -0.098 0 C-N-CA 125.599 1.56 . . . . 0.0 112.826 176.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 19.9 mt . . . . . 0 C--O 1.234 0.27 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -108.85 149.1 29.6 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 126.482 1.913 . . . . 0.0 108.048 -179.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.44 ' CD1' HD11 ' A' ' 61' ' ' LEU . 57.9 m-85 -71.73 153.51 41.96 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 176.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.15 16.95 73.48 Favored Glycine 0 CA--C 1.531 1.067 0 CA-C-O 119.509 -0.606 . . . . 0.0 114.087 -173.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -59.65 -25.46 64.72 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.09 1.445 . . . . 0.0 113.283 175.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.7 ttmt 69.75 142.29 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 127.759 2.423 . . . . 0.0 111.006 -175.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.68 146.81 47.96 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 105.497 -2.038 . . . . 0.0 105.497 165.348 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 72.5 t -135.28 143.71 36.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 106.343 -1.725 . . . . 0.0 106.343 170.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -125.3 -179.13 4.46 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.03 1.732 . . . . 0.0 111.627 -177.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.41 -19.49 65.96 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.977 1.102 . . . . 0.0 113.977 179.109 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -85.69 0.18 53.45 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 118.869 0.759 . . . . 0.0 111.065 175.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 54.78 31.7 16.07 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 126.16 1.784 . . . . 0.0 110.107 -168.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 29.6 m170 -71.23 115.21 10.11 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 120.248 -1.533 . . . . 0.0 107.151 166.276 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.2 m -77.03 147.51 36.72 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 167.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -135.92 159.7 40.87 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 125.014 1.325 . . . . 0.0 108.125 169.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 27.2 t -137.84 135.13 45.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 C-N-CA 129.061 2.944 . . . . 0.0 106.333 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.44 HD11 ' CD1' ' A' ' 47' ' ' TYR . 0.4 OUTLIER -78.27 140.02 38.87 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 175.127 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -113.49 161.16 17.69 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 123.259 0.624 . . . . 0.0 109.824 175.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -53.15 -25.61 14.03 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.655 0.782 . . . . 0.0 112.528 -177.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.83 -12.15 2.87 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 129.404 3.082 . . . . 0.0 114.041 172.192 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 63.69 36.73 10.55 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-N 120.423 1.465 . . . . 0.0 110.851 -174.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -124.3 173.57 8.29 Favored 'General case' 0 N--CA 1.457 -0.099 0 C-N-CA 125.072 1.349 . . . . 0.0 111.161 164.375 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 70.7 m95 -115.89 121.28 41.86 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 125.074 1.35 . . . . 0.0 107.87 177.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -95.34 155.79 38.39 Favored Pre-proline 0 N--CA 1.439 -0.981 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 179.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -66.53 121.36 8.6 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 123.084 2.523 . . . . 0.0 109.094 170.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -108.23 40.53 1.74 Allowed 'General case' 0 C--O 1.236 0.35 0 C-N-CA 124.747 1.219 . . . . 0.0 109.987 -177.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.85 165.91 0.13 Allowed Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 127.136 2.174 . . . . 0.0 112.682 179.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -71.79 178.0 6.3 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 121.567 1.511 . . . . 0.0 111.007 166.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 15.7 tp -142.65 145.06 32.6 Favored Pre-proline 0 CA--C 1.535 0.369 0 C-N-CA 124.083 0.953 . . . . 0.0 111.648 -169.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -67.81 165.88 26.29 Favored 'Trans proline' 0 CA--C 1.536 0.617 0 C-N-CA 122.619 2.213 . . . . 0.0 113.039 176.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -61.77 -22.5 74.51 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 123.688 2.925 . . . . 0.0 113.257 173.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -86.36 -16.37 37.59 Favored 'General case' 0 C--N 1.332 -0.179 0 O-C-N 121.304 -0.872 . . . . 0.0 112.25 176.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -67.55 -32.89 79.78 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 120.537 -0.839 . . . . 0.0 111.958 179.326 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 35.8 tp -53.97 -58.62 6.63 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 118.054 0.927 . . . . 0.0 108.581 168.227 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -46.14 -37.69 7.27 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 126.52 1.928 . . . . 0.0 113.502 178.717 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -70.86 -37.21 73.08 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 124.583 1.153 . . . . 0.0 112.005 -177.518 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.2 tp -70.37 -51.45 29.72 Favored 'General case' 0 CA--C 1.521 -0.15 0 C-N-CA 124.866 1.266 . . . . 0.0 110.964 175.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 27.6 mm -57.47 -35.54 50.07 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 -177.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -46.22 -39.22 9.48 Favored 'General case' 0 C--O 1.224 -0.253 0 C-N-CA 124.798 1.239 . . . . 0.0 112.988 173.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.97 -62.27 1.98 Allowed 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 123.718 0.807 . . . . 0.0 109.599 178.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 42.8 t60 -57.7 -39.14 76.52 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.151 0.98 . . . . 0.0 110.723 -177.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 66.0 m -64.88 -41.12 95.89 Favored 'General case' 0 N--CA 1.448 -0.527 0 O-C-N 121.438 -0.789 . . . . 0.0 111.788 176.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.33 -38.27 81.37 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 124.493 1.117 . . . . 0.0 112.302 179.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.2 t -64.44 -40.56 95.98 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 118.895 0.77 . . . . 0.0 109.809 178.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 85.2 mt -82.11 -72.35 0.44 Allowed 'General case' 0 C--O 1.233 0.227 0 C-N-CA 123.819 0.848 . . . . 0.0 108.789 -176.108 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 143.61 42.19 0.06 OUTLIER Glycine 0 CA--C 1.525 0.7 0 C-N-CA 124.761 1.172 . . . . 0.0 111.212 -177.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 70.8 m-70 . . . . . 0 C--O 1.234 0.248 0 C-N-CA 124.136 0.974 . . . . 0.0 111.347 -174.948 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.536 0.412 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 97.1 mt -149.41 153.25 37.07 Favored 'General case' 0 CA--C 1.511 -0.522 0 C-N-CA 126.476 1.91 . . . . 0.0 109.279 -174.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 26.2 t-80 -76.32 -47.09 24.77 Favored 'General case' 0 N--CA 1.444 -0.728 0 C-N-CA 124.407 1.083 . . . . 0.0 112.018 167.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 53.9 m -170.14 179.11 3.62 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 125.461 1.504 . . . . 0.0 111.154 -171.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 63.8 t -66.47 -42.97 91.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 CA-C-N 119.602 1.092 . . . . 0.0 111.089 -174.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 4.4 tpt -56.83 -46.77 81.48 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 118.714 0.688 . . . . 0.0 109.405 -179.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -58.53 -36.84 74.48 Favored 'General case' 0 C--N 1.339 0.147 0 C-N-CA 124.143 0.977 . . . . 0.0 110.194 177.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.62 -45.73 85.63 Favored 'General case' 0 C--O 1.227 -0.131 0 C-N-CA 123.418 0.687 . . . . 0.0 111.929 178.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 30.1 mm -59.03 -47.78 88.82 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 -177.019 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -75.82 -32.04 59.65 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 118.834 -0.603 . . . . 0.0 111.31 -177.328 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -60.18 -56.4 22.02 Favored 'General case' 0 C--N 1.342 0.25 0 C-N-CA 123.922 0.889 . . . . 0.0 110.202 173.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 25.3 mt -57.6 -43.25 84.55 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -175.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -68.86 -7.69 36.87 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 175.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -107.03 -7.95 16.74 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 119.817 1.19 . . . . 0.0 112.601 176.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . 0.293 1.3 tp . . . . . 0 N--CA 1.416 -2.151 0 C-N-CA 126.472 1.909 . . . . 0.0 109.063 -177.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 6.8 p . . . . . 0 C--O 1.239 0.518 0 N-CA-C 110.572 -0.158 . . . . 0.0 110.572 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -68.18 -55.37 0.25 Allowed 'Trans proline' 0 N--CA 1.45 -1.081 0 C-N-CA 121.699 1.599 . . . . 0.0 110.842 169.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -140.45 153.88 68.91 Favored Pre-proline 0 CA--C 1.542 0.65 0 C-N-CA 126.949 2.1 . . . . 0.0 108.481 177.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -85.25 -17.94 4.32 Favored 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 122.75 2.3 . . . . 0.0 113.513 173.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -78.82 -17.61 55.41 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 118.905 0.775 . . . . 0.0 112.278 -179.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.99 135.22 53.42 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.455 0.702 . . . . 0.0 111.013 165.224 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.428 ' CG1' HD22 ' A' ' 55' ' ' ASN . 47.9 mm -123.07 108.02 20.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 C-N-CA 127.27 2.228 . . . . 0.0 106.892 176.483 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 56.6 m95 -52.6 151.99 7.19 Favored Pre-proline 0 C--O 1.238 0.473 0 C-N-CA 124.68 1.192 . . . . 0.0 111.644 -179.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -69.69 169.44 63.06 Favored 'Cis proline' 0 N--CA 1.457 -0.658 0 N-CA-C 115.411 1.274 . . . . 0.0 115.411 -0.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.78 171.23 14.71 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.596 1.159 . . . . 0.0 111.392 -175.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -146.53 102.78 3.61 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.514 1.125 . . . . 0.0 111.04 -165.303 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.9 tp -78.32 150.32 33.3 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 123.35 0.66 . . . . 0.0 109.23 177.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.7 84.98 1.36 Allowed 'General case' 0 C--O 1.237 0.416 0 CA-C-N 119.082 0.855 . . . . 0.0 110.574 174.404 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -59.76 158.59 10.11 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 123.565 0.746 . . . . 0.0 110.762 -167.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -67.22 125.33 25.72 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 122.836 1.303 . . . . 0.0 111.135 178.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 85.75 -31.96 3.82 Favored Glycine 0 CA--C 1.528 0.871 0 C-N-CA 125.692 1.615 . . . . 0.0 111.904 178.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 39.4 m -68.14 169.19 10.7 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 118.448 1.124 . . . . 0.0 110.077 170.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -141.1 -16.4 0.85 Allowed 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 125.265 1.426 . . . . 0.0 111.958 -175.021 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -71.03 105.94 3.51 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 175.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.452 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 3.9 mm? -60.37 137.86 58.07 Favored 'General case' 0 N--CA 1.462 0.162 0 N-CA-C 106.903 -1.518 . . . . 0.0 106.903 171.498 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.56 88.12 8.9 Favored Pre-proline 0 C--N 1.33 -0.261 0 C-N-CA 125.308 1.443 . . . . 0.0 107.864 -174.648 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -62.54 132.06 36.39 Favored 'Trans proline' 0 CA--C 1.541 0.829 0 C-N-CA 123.208 2.605 . . . . 0.0 109.994 176.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -119.4 118.05 30.13 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 106.105 -1.813 . . . . 0.0 106.105 168.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 72.7 mtm180 -75.03 -47.02 31.11 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 -174.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 67.4 p -135.59 178.59 6.92 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.815 0.846 . . . . 0.0 110.903 -179.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -60.03 -39.5 86.12 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.452 -0.78 . . . . 0.0 109.582 175.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -56.66 -23.81 44.17 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.459 1.104 . . . . 0.0 111.371 176.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -93.86 -32.51 13.9 Favored 'General case' 0 N--CA 1.454 -0.272 0 O-C-N 120.756 -1.215 . . . . 0.0 111.058 -172.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 11.0 t-105 -58.06 -42.83 86.3 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 165.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -53.53 -60.29 3.5 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 172.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.508 0 C-N-CA 117.556 -1.658 . . . . 0.0 110.204 -163.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 48.5 mt . . . . . 0 C--O 1.234 0.252 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -142.78 163.61 32.34 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 125.941 1.696 . . . . 0.0 107.54 -178.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.458 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 20.6 m-85 -55.95 138.23 49.2 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.77 0.795 . . . . 0.0 110.67 -179.108 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.28 7.69 76.15 Favored Glycine 0 CA--C 1.536 1.384 0 CA-C-O 118.096 -1.391 . . . . 0.0 114.244 179.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.97 -27.17 61.02 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 119.716 1.758 . . . . 0.0 115.483 -170.487 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 22.0 ttmt 57.62 152.2 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 130.38 3.472 . . . . 0.0 115.791 174.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.4 tp -141.19 155.58 46.04 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 174.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 97.0 t -130.58 155.43 41.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 105.105 -2.183 . . . . 0.0 105.105 157.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -123.5 -179.74 4.45 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 126.521 1.928 . . . . 0.0 111.76 176.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.5 m -68.55 -17.12 64.08 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 114.857 1.428 . . . . 0.0 114.857 177.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.428 HD22 ' CG1' ' A' ' 12' ' ' ILE . 67.0 m-80 -77.36 -7.81 56.68 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 120.433 1.469 . . . . 0.0 111.27 168.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 64.66 32.28 11.44 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.885 1.274 . . . . 0.0 110.713 -167.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 54.1 m170 -83.61 110.3 18.13 Favored 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 166.398 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.5 m -79.67 149.18 31.33 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 169.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -146.64 164.81 31.49 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 125.448 1.499 . . . . 0.0 110.623 176.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 7.6 p -153.72 150.89 11.97 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 CA-C-N 120.372 1.442 . . . . 0.0 113.871 170.028 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 38.6 tp -72.19 135.62 46.17 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.744 2.017 . . . . 0.0 109.301 176.34 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -116.25 -179.74 3.76 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.313 1.045 . . . . 0.0 109.27 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.458 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 14.7 mp0 -60.32 -20.96 61.34 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.885 1.274 . . . . 0.0 113.826 -177.305 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -90.91 16.44 9.45 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.416 1.086 . . . . 0.0 112.552 -173.277 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 61.38 -0.57 0.36 Allowed 'General case' 0 C--O 1.239 0.547 0 C-N-CA 126.855 2.062 . . . . 0.0 114.075 -172.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -82.29 171.99 13.62 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 118.864 0.756 . . . . 0.0 111.164 176.379 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 26.2 m95 -115.57 147.14 41.07 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 168.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -134.55 162.87 55.13 Favored Pre-proline 0 CA--C 1.532 0.256 0 C-N-CA 125.272 1.429 . . . . 0.0 111.272 -169.013 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -72.19 133.15 20.68 Favored 'Trans proline' 0 CA--C 1.535 0.548 0 C-N-CA 123.5 2.8 . . . . 0.0 112.587 -176.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -114.46 29.52 7.96 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.999 1.32 . . . . 0.0 111.432 175.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 70.05 165.35 0.13 Allowed Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 127.615 2.366 . . . . 0.0 111.899 -178.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -70.43 173.01 12.2 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 121.207 1.271 . . . . 0.0 110.259 168.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 12.6 tp -127.19 144.29 50.09 Favored Pre-proline 0 CA--C 1.533 0.322 0 CA-C-O 117.755 -1.117 . . . . 0.0 108.569 -178.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -76.02 169.36 22.27 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 122.761 2.307 . . . . 0.0 110.19 173.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -63.02 -30.31 76.15 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 121.889 1.726 . . . . 0.0 112.918 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -82.1 -21.52 36.71 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 119.385 0.993 . . . . 0.0 111.459 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.22 -16.28 57.72 Favored Glycine 0 CA--C 1.534 1.247 0 O-C-N 121.872 -0.518 . . . . 0.0 112.457 178.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 23.8 tp -61.04 -52.55 64.51 Favored 'General case' 0 C--O 1.232 0.148 0 C-N-CA 126.133 1.773 . . . . 0.0 109.592 172.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -71.65 -34.13 69.49 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 125.306 1.442 . . . . 0.0 109.088 -169.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -52.57 -48.44 66.19 Favored 'General case' 0 CA--C 1.516 -0.333 0 C-N-CA 126.185 1.794 . . . . 0.0 112.081 172.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 28.9 mt -65.01 -58.2 6.72 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.416 177.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 16.4 mm -58.86 -25.0 27.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.339 0 CA-C-O 118.952 -0.546 . . . . 0.0 111.984 -175.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 5.7 ttm180 -46.32 -40.37 11.67 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-O 117.909 -1.043 . . . . 0.0 111.523 173.104 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -67.29 -45.85 75.32 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 119.385 0.993 . . . . 0.0 112.041 -178.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.452 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 10.9 t60 -61.96 -45.43 93.68 Favored 'General case' 0 C--O 1.223 -0.3 0 C-N-CA 124.473 1.109 . . . . 0.0 109.318 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 99.1 m -69.42 -46.11 67.59 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 121.548 -0.72 . . . . 0.0 110.657 -179.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.23 -44.72 95.91 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 118.392 -0.813 . . . . 0.0 110.861 -177.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 8.4 t -67.25 -17.86 64.97 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 117.986 -1.007 . . . . 0.0 112.181 -175.198 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 83.7 mt -110.64 -35.31 6.04 Favored 'General case' 0 C--N 1.341 0.222 0 CA-C-N 119.097 0.862 . . . . 0.0 111.524 -172.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 115.18 17.91 6.52 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.975 1.274 . . . . 0.0 113.293 -179.33 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 20.6 m170 . . . . . 0 C--O 1.242 0.681 0 CA-C-N 118.404 1.102 . . . . 0.0 111.556 -173.898 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.533 0.318 0 N-CA-C 113.569 0.951 . . . . 0.0 113.569 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 18.4 mt -141.97 118.63 11.03 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 -161.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 13.0 t-160 -69.76 -43.08 72.97 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 118.323 0.51 . . . . 0.0 110.941 172.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 67.5 m -145.23 166.89 24.17 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 124.337 1.055 . . . . 0.0 110.199 -164.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 70.4 t -55.35 -35.7 37.86 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 169.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 2.8 tpt -52.76 -47.48 67.43 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 125.151 1.38 . . . . 0.0 112.024 175.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -59.06 -50.86 72.48 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.86 -48.83 78.76 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 125.112 1.365 . . . . 0.0 112.83 -172.445 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 19.9 mm -58.72 -45.1 91.2 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 -176.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -67.58 -43.0 81.63 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 122.725 0.41 . . . . 0.0 111.135 -178.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 44.6 t80 -50.18 -60.1 3.29 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.429 1.091 . . . . 0.0 110.246 176.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 9.0 mp -54.77 -45.79 74.31 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 125.04 1.336 . . . . 0.0 111.933 175.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -61.16 -31.57 71.3 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 119.606 -0.235 . . . . 0.0 111.515 -179.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -78.16 -18.58 55.38 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.923 0.889 . . . . 0.0 112.4 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 47.0 mt . . . . . 0 C--O 1.233 0.204 0 C-N-CA 124.955 1.302 . . . . 0.0 111.104 -177.613 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.474 0.747 0 CA-C-O 119.231 -0.414 . . . . 0.0 111.462 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.45 -47.43 0.18 Allowed 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.558 2.172 . . . . 0.0 111.595 177.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 16.4 t-80 -147.62 148.14 29.91 Favored Pre-proline 0 C--O 1.235 0.311 0 C-N-CA 126.882 2.073 . . . . 0.0 106.738 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -75.91 -32.95 4.05 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 121.318 1.345 . . . . 0.0 112.843 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -84.61 -4.43 58.99 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 117.872 -1.061 . . . . 0.0 112.713 179.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 tt -66.97 127.68 33.47 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 119.786 1.176 . . . . 0.0 108.09 165.03 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 24.1 mm -115.26 119.56 62.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 -177.156 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 75.7 m95 -63.66 152.91 85.12 Favored Pre-proline 0 CA--C 1.538 0.491 0 C-N-CA 123.441 0.696 . . . . 0.0 111.749 -177.021 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -74.36 168.89 75.57 Favored 'Cis proline' 0 CA--C 1.532 0.422 0 N-CA-C 113.376 0.491 . . . . 0.0 113.376 -0.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -126.97 166.88 16.7 Favored 'General case' 0 CA--C 1.521 -0.151 0 C-N-CA 124.024 0.929 . . . . 0.0 111.258 178.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 12.9 mt -143.26 102.37 3.96 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 126.186 1.795 . . . . 0.0 107.051 -178.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.9 tp -78.51 138.08 38.24 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 170.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.418 ' HE3' ' O ' ' A' ' 22' ' ' CYS . 0.0 OUTLIER -134.55 91.63 2.81 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 106.608 -1.626 . . . . 0.0 106.608 170.868 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -55.93 147.79 18.7 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 124.005 0.816 . . . . 0.0 111.974 -174.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -73.5 97.12 2.51 Favored 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 124.731 1.212 . . . . 0.0 110.345 -178.366 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 133.76 -49.43 0.91 Allowed Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 126.282 1.896 . . . . 0.0 108.978 -177.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.418 ' O ' ' HE3' ' A' ' 18' ' ' LYS . 35.8 m -65.41 172.96 2.87 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 124.827 1.251 . . . . 0.0 111.076 -178.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 18.0 m-80 -129.29 -31.2 2.09 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 124.736 1.215 . . . . 0.0 109.302 175.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -67.27 95.71 0.44 Allowed 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 128.19 2.596 . . . . 0.0 108.963 -175.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.411 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 3.1 mm? -53.36 143.61 18.5 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.734 0.813 . . . . 0.0 109.819 178.537 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -111.97 87.42 8.65 Favored Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 125.705 1.602 . . . . 0.0 108.603 173.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -62.55 136.81 60.78 Favored 'Trans proline' 0 CA--C 1.535 0.546 1 C-N-CA 125.712 4.275 . . . . 0.0 111.75 174.164 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -124.14 114.79 20.14 Favored 'General case' 0 N--CA 1.462 0.134 0 C-N-CA 125.961 1.704 . . . . 0.0 108.244 170.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.6 mmm180 -62.35 -56.21 20.61 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 126.057 1.743 . . . . 0.0 109.995 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 61.6 p -139.05 -178.21 5.24 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 124.353 1.061 . . . . 0.0 108.621 178.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -59.67 -29.54 68.14 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.505 -0.747 . . . . 0.0 111.885 167.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -61.67 -23.44 66.09 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.68 0.792 . . . . 0.0 111.168 175.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -84.45 -46.79 11.3 Favored 'General case' 0 C--O 1.223 -0.293 0 C-N-CA 126.335 1.854 . . . . 0.0 109.754 177.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 39.0 t-105 -55.48 -38.5 69.21 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 120.776 -1.203 . . . . 0.0 110.982 175.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 4.4 mm100 -61.34 -43.07 99.49 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.599 1.16 . . . . 0.0 111.85 172.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 69.5 mtt85 . . . . . 0 CA--C 1.518 -0.281 0 CA-C-O 118.572 -0.727 . . . . 0.0 110.988 176.514 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.8 mt . . . . . 0 C--O 1.24 0.563 0 N-CA-C 105.988 -1.856 . . . . 0.0 105.988 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -136.07 163.99 29.05 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 124.039 0.936 . . . . 0.0 111.591 -168.525 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -69.0 109.86 4.17 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 106.722 -1.584 . . . . 0.0 106.722 -172.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 116.18 -4.71 20.12 Favored Glycine 0 CA--C 1.528 0.879 0 CA-C-O 117.62 -1.655 . . . . 0.0 114.805 -178.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -68.99 -2.64 10.39 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-N 120.703 2.251 . . . . 0.0 116.164 -169.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 9.6 ttmt 51.45 119.0 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 131.56 3.944 . . . . 0.0 116.473 167.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 10.3 mt -106.78 149.27 27.51 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 107.81 -1.182 . . . . 0.0 107.81 165.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 55.4 t -131.31 148.08 32.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 104.556 -2.386 . . . . 0.0 104.556 167.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -127.79 175.3 8.43 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 131.471 3.908 . . . . 0.0 110.36 -169.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.0 p -58.71 -35.19 72.26 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.803 0.841 . . . . 0.0 112.896 -179.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 40.6 m-20 -83.02 -0.43 48.85 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.657 1.583 . . . . 0.0 113.49 -176.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 62.64 22.06 13.09 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 120.028 1.286 . . . . 0.0 111.38 -177.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 34.7 m170 -71.02 103.85 2.82 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 119.85 -1.781 . . . . 0.0 110.086 160.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.07 146.44 54.18 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 120.108 1.322 . . . . 0.0 107.682 171.113 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -134.3 149.25 50.88 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 124.629 1.172 . . . . 0.0 108.091 174.39 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 37.1 t -137.01 140.11 43.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 C-N-CA 126.798 2.039 . . . . 0.0 106.915 175.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 27.9 tp -72.0 138.95 48.33 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 125.738 1.615 . . . . 0.0 107.995 173.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -109.86 168.94 9.05 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 124.32 1.048 . . . . 0.0 110.292 178.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -60.27 -37.65 81.12 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.866 0.867 . . . . 0.0 110.571 178.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -73.48 10.66 0.97 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.95 1.3 . . . . 0.0 113.264 176.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 74.14 7.58 4.72 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 127.803 2.441 . . . . 0.0 114.532 164.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -92.17 168.3 11.45 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.55 1.14 . . . . 0.0 110.296 170.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 58.5 m95 -105.13 96.84 6.8 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 108.177 -1.045 . . . . 0.0 108.177 175.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 53.4 t-80 -69.88 144.39 93.2 Favored Pre-proline 0 CA--C 1.543 0.708 0 CA-C-N 118.013 0.369 . . . . 0.0 110.006 179.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -69.4 103.03 1.04 Allowed 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 124.49 3.46 . . . . 0.0 111.262 171.536 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -83.45 37.01 0.55 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.293 1.837 . . . . 0.0 112.395 -178.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 67.59 165.28 0.12 Allowed Pre-proline 0 CA--C 1.546 0.809 0 C-N-CA 128.002 2.521 . . . . 0.0 112.716 178.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -72.71 174.65 11.42 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 121.526 1.484 . . . . 0.0 113.176 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.6 tt -131.49 143.73 50.42 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 127.157 2.183 . . . . 0.0 108.406 -168.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -89.43 166.47 5.29 Favored 'Trans proline' 0 CA--C 1.538 0.725 0 C-N-CA 124.065 3.177 . . . . 0.0 112.396 -178.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -58.19 -19.58 42.59 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.898 2.399 . . . . 0.0 113.93 178.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -101.56 -17.41 16.4 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 124.127 0.971 . . . . 0.0 111.086 -177.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.53 -40.37 98.67 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.135 -1.186 . . . . 0.0 110.135 174.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 54.6 tp -60.83 -50.21 74.35 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 179.018 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -63.61 -19.64 65.02 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.638 1.175 . . . . 0.0 111.793 -177.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -77.43 -47.13 20.54 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 119.696 1.135 . . . . 0.0 110.793 170.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 29.4 mt -57.63 -54.46 46.58 Favored 'General case' 0 N--CA 1.466 0.367 0 O-C-N 121.807 -0.558 . . . . 0.0 110.305 174.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 20.2 mm -58.11 -33.1 45.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 C-N-CA 125.084 1.354 . . . . 0.0 110.443 -178.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.86 -33.73 37.63 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 119.081 0.855 . . . . 0.0 111.729 174.369 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.4 -54.43 40.43 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 119.159 0.89 . . . . 0.0 110.472 -177.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.411 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 8.6 t60 -64.15 -39.33 93.8 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.478 0.711 . . . . 0.0 109.941 179.072 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 80.6 m -70.2 -40.82 74.37 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 121.327 -0.858 . . . . 0.0 111.405 -178.015 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -75.92 -31.06 58.96 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 118.925 0.784 . . . . 0.0 111.884 -177.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.8 t -66.1 -40.67 90.95 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 176.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 98.0 mt -81.16 -70.7 0.51 Allowed 'General case' 0 C--N 1.341 0.238 0 CA-C-O 118.596 -0.716 . . . . 0.0 109.256 -176.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 153.2 39.63 0.02 OUTLIER Glycine 0 CA--C 1.53 0.989 0 CA-C-O 118.572 -1.127 . . . . 0.0 113.768 171.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.541 0.629 0 CA-C-N 118.938 1.369 . . . . 0.0 111.841 -172.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.548 0.874 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 81.3 mt -144.47 171.24 14.63 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 128.385 2.674 . . . . 0.0 110.126 -157.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 29.7 t-80 -106.48 -27.16 11.08 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 126.217 1.807 . . . . 0.0 112.156 176.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 3.0 m -172.86 172.79 3.96 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.139 1.376 . . . . 0.0 111.392 -172.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 34.7 t -66.56 -44.66 89.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 175.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 51.2 tpp -56.99 -40.11 75.95 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.398 -0.814 . . . . 0.0 111.506 178.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -69.11 -31.33 69.95 Favored 'General case' 0 C--O 1.233 0.195 0 O-C-N 122.17 -0.331 . . . . 0.0 110.85 179.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.24 -46.87 81.88 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.656 1.182 . . . . 0.0 110.043 173.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 42.4 mm -56.68 -37.45 52.9 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.215 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 176.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.46 -47.35 61.03 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 119.331 0.968 . . . . 0.0 111.399 177.176 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -54.41 -55.2 31.14 Favored 'General case' 0 N--CA 1.461 0.083 0 C-N-CA 125.563 1.545 . . . . 0.0 111.57 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 63.7 mt -62.72 -34.86 78.04 Favored 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 124.527 1.131 . . . . 0.0 110.721 -173.218 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -74.18 -44.22 54.28 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 124.293 1.037 . . . . 0.0 110.251 -176.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -64.88 2.5 0.7 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.608 1.563 . . . . 0.0 114.2 178.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 69.7 mt . . . . . 0 CA--C 1.529 0.143 0 C-N-CA 124.216 1.006 . . . . 0.0 112.1 169.179 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.238 0.47 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -67.72 -49.27 1.18 Allowed 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.685 2.257 . . . . 0.0 112.002 175.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 4.5 t-80 -158.77 144.88 12.41 Favored Pre-proline 0 CA--C 1.534 0.332 0 CA-C-O 117.645 -1.169 . . . . 0.0 110.81 -175.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -72.24 -20.58 24.43 Favored 'Trans proline' 0 CA--C 1.534 0.486 0 C-N-CA 123.157 2.571 . . . . 0.0 112.96 175.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -85.03 -9.4 58.05 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.282 -0.886 . . . . 0.0 111.9 176.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.3 tt -78.67 132.21 36.95 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 123.957 0.903 . . . . 0.0 109.713 170.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 24.1 mm -120.53 114.11 42.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 176.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -56.5 153.8 19.28 Favored Pre-proline 0 C--O 1.238 0.456 0 CA-C-O 118.874 -0.584 . . . . 0.0 111.642 178.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -68.56 172.16 45.33 Favored 'Cis proline' 0 CA--C 1.535 0.563 0 N-CA-C 114.195 0.806 . . . . 0.0 114.195 -1.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -136.2 171.63 14.19 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.521 0.728 . . . . 0.0 112.132 176.105 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 14.5 mt -143.38 108.32 4.93 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 127.555 2.342 . . . . 0.0 106.901 -177.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.6 tp -83.3 148.38 27.4 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 170.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.66 90.26 1.91 Allowed 'General case' 0 C--O 1.238 0.499 0 CA-C-N 119.739 1.154 . . . . 0.0 109.759 171.07 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.442 HE21 ' CG ' ' A' ' 49' ' ' ASP . 4.8 mt-30 -48.98 152.48 1.05 Allowed 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 125.687 1.595 . . . . 0.0 111.932 -172.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -70.16 -11.18 60.71 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.835 0.68 . . . . 0.0 112.835 173.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -95.79 -17.66 34.86 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 124.995 1.283 . . . . 0.0 113.57 -178.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 1.3 m -129.81 -176.48 3.93 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 119.254 1.527 . . . . 0.0 110.583 -171.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -132.21 -19.47 2.5 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 126.352 1.861 . . . . 0.0 110.612 -176.004 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -67.68 155.36 39.39 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 167.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.438 ' HB2' ' HD1' ' A' ' 85' ' ' HIS . 2.3 mt -102.0 165.11 11.35 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 125.079 1.352 . . . . 0.0 108.937 172.456 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -118.19 88.33 32.11 Favored Pre-proline 0 C--N 1.328 -0.346 0 C-N-CA 125.774 1.63 . . . . 0.0 108.468 171.413 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -62.2 128.59 24.37 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 122.682 2.255 . . . . 0.0 110.225 173.039 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -120.56 109.07 14.82 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.15 1.38 . . . . 0.0 108.056 172.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 79.0 mtm180 -66.14 -47.79 72.91 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 125.344 1.458 . . . . 0.0 113.048 -173.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.14 168.11 22.44 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 126.351 1.86 . . . . 0.0 106.508 -177.468 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 -53.56 -33.28 54.15 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 126.24 1.816 . . . . 0.0 113.628 -176.125 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -56.53 -35.29 67.92 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.49 1.516 . . . . 0.0 111.575 175.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -66.67 -47.27 73.01 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.264 1.826 . . . . 0.0 109.891 -177.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 36.1 t-105 -61.88 -41.27 97.68 Favored 'General case' 0 C--N 1.345 0.38 0 O-C-N 120.771 -1.206 . . . . 0.0 110.719 176.264 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -59.56 -54.79 42.51 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 175.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 61.7 mtp180 . . . . . 0 C--O 1.226 -0.147 0 CA-C-O 117.656 -1.164 . . . . 0.0 112.408 179.557 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 36.1 mt . . . . . 0 N--CA 1.468 0.46 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -144.83 150.38 37.03 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 121.85 0.833 . . . . 0.0 110.647 -166.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.402 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 3.4 m-85 -62.13 130.1 43.88 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 173.508 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 100.55 5.87 53.54 Favored Glycine 0 CA--C 1.527 0.833 0 CA-C-O 118.441 -1.199 . . . . 0.0 114.301 -176.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.442 ' CG ' HE21 ' A' ' 19' ' ' GLN . 5.4 m-20 -75.71 -6.76 52.07 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 115.905 1.817 . . . . 0.0 115.905 -166.775 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 16.2 ttmt 53.07 130.71 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 130.238 3.415 . . . . 0.0 116.692 173.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 5.9 tp -122.02 154.76 36.83 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 175.402 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 41.0 t -138.04 131.6 41.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 C-N-CA 126.587 1.955 . . . . 0.0 107.0 175.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -107.14 -178.75 3.73 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.446 1.498 . . . . 0.0 113.41 178.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.6 t -56.72 -13.94 2.91 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 128.385 2.674 . . . . 0.0 115.103 177.596 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -122.69 11.87 9.84 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 126.823 2.049 . . . . 0.0 109.733 -173.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 66.96 16.43 10.36 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.895 1.678 . . . . 0.0 110.589 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 25.0 m170 -61.45 108.53 0.96 Allowed 'General case' 0 C--O 1.24 0.565 0 CA-C-N 120.363 1.438 . . . . 0.0 107.995 168.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -82.29 149.42 27.8 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 173.556 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -138.55 164.49 29.3 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 171.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 25.6 t -133.27 138.78 50.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 C-N-CA 128.087 2.555 . . . . 0.0 106.425 172.188 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 16.0 tp -80.16 137.32 36.68 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 171.155 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -121.84 170.91 9.31 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.38 1.072 . . . . 0.0 110.371 174.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.563 ' H ' ' CD ' ' A' ' 63' ' ' GLU . 0.7 OUTLIER -66.99 -18.57 65.45 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.584 1.553 . . . . 0.0 111.433 -171.086 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -78.16 16.45 0.76 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.903 1.281 . . . . 0.0 110.958 172.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 61.45 0.97 0.5 Allowed 'General case' 0 C--O 1.239 0.549 0 C-N-CA 129.746 3.219 . . . . 0.0 114.979 176.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 2.2 p-80 -85.12 156.49 21.03 Favored 'General case' 0 N--CA 1.437 -1.105 0 CA-C-O 121.781 0.801 . . . . 0.0 109.269 175.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 81.4 m95 -83.93 142.52 30.48 Favored 'General case' 0 N--CA 1.437 -1.077 0 N-CA-C 104.801 -2.296 . . . . 0.0 104.801 153.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 22.3 t-80 -114.1 143.99 30.76 Favored Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 171.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.78 103.3 0.98 Allowed 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 124.574 3.516 . . . . 0.0 111.058 176.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -79.6 29.91 0.24 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.705 1.602 . . . . 0.0 111.857 177.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 66.5 165.47 0.12 Allowed Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 128.156 2.583 . . . . 0.0 111.705 -173.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -63.36 170.23 8.34 Favored 'Trans proline' 0 N--CA 1.45 -1.034 0 C-N-CA 121.179 1.253 . . . . 0.0 110.864 167.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 13.4 tp -123.82 145.83 48.82 Favored Pre-proline 0 C--O 1.237 0.421 0 C-N-CA 124.519 1.127 . . . . 0.0 109.211 -174.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -61.46 158.78 34.6 Favored 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 123.33 2.686 . . . . 0.0 111.484 174.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -59.2 -27.23 84.45 Favored 'Trans proline' 0 N--CA 1.457 -0.674 0 C-N-CA 122.634 2.223 . . . . 0.0 112.398 179.159 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -96.11 -12.37 24.88 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.599 0.76 . . . . 0.0 111.102 -173.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.43 -28.12 68.37 Favored Glycine 0 CA--C 1.527 0.833 0 C-N-CA 123.807 0.718 . . . . 0.0 111.753 175.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 36.4 tp -52.95 -59.23 4.78 Favored 'General case' 0 C--N 1.34 0.158 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 165.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -62.59 -20.13 64.42 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.898 1.279 . . . . 0.0 112.13 -169.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -75.48 -44.94 41.35 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.577 1.151 . . . . 0.0 111.141 172.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 41.4 mt -61.65 -44.09 97.63 Favored 'General case' 0 C--O 1.234 0.257 0 O-C-N 121.009 -1.057 . . . . 0.0 110.08 173.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 37.0 mm -56.95 -41.52 77.02 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 123.25 0.62 . . . . 0.0 109.514 173.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -50.38 -42.83 54.0 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 124.413 1.085 . . . . 0.0 112.309 -179.18 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -67.44 -43.63 80.66 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 119.1 0.864 . . . . 0.0 110.952 -179.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.438 ' HD1' ' HB2' ' A' ' 25' ' ' LEU . 3.9 t-160 -58.68 -46.38 87.36 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 177.356 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 30.5 m -60.41 -44.31 95.84 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-O 118.361 -0.828 . . . . 0.0 111.244 175.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -71.48 -27.78 63.47 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 117.623 -1.179 . . . . 0.0 112.094 -172.072 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 8.4 t -70.86 -40.77 72.11 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 119.984 1.266 . . . . 0.0 108.872 177.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 58.8 mt -89.47 -63.5 1.28 Allowed 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 -174.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 157.7 9.57 0.05 OUTLIER Glycine 0 CA--C 1.536 1.351 0 C-N-CA 125.412 1.482 . . . . 0.0 114.428 174.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 21.6 p80 . . . . . 0 N--CA 1.468 0.474 0 CA-C-N 120.354 2.077 . . . . 0.0 114.237 -150.771 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.543 0.699 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 75.2 mt -142.67 141.3 31.84 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 126.643 1.977 . . . . 0.0 109.37 -169.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 9.8 t-160 -75.75 -27.22 58.01 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.063 0.545 . . . . 0.0 112.082 -174.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 11.2 p 179.69 179.56 0.49 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.191 1.396 . . . . 0.0 109.692 -174.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 6.5 t -64.65 -45.53 95.09 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.21 0 C-N-CA 123.58 0.752 . . . . 0.0 109.054 -178.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 6.7 tpt -62.98 -32.82 74.25 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 121.727 -0.608 . . . . 0.0 110.682 -177.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.76 -37.84 70.46 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.186 0.994 . . . . 0.0 109.491 177.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.74 -43.15 97.35 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 125.635 1.574 . . . . 0.0 112.455 176.159 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 33.9 mm -61.26 -50.63 79.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -179.503 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -66.34 -39.16 89.02 Favored 'General case' 0 C--O 1.226 -0.177 0 O-C-N 123.369 0.418 . . . . 0.0 110.326 -176.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -53.91 -56.37 18.36 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 124.548 1.139 . . . . 0.0 111.117 172.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 31.7 mt -62.43 -38.78 91.04 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 111.761 0.282 . . . . 0.0 111.761 -177.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -64.87 -41.41 95.69 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 177.244 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -70.33 -13.35 62.11 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 118.111 -0.947 . . . . 0.0 113.161 -178.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 94.9 mt . . . . . 0 N--CA 1.463 0.187 0 CA-C-N 120.082 1.31 . . . . 0.0 110.934 172.456 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.544 0.733 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -77.92 -165.08 0.31 Allowed 'Trans proline' 0 CA--C 1.548 1.185 0 C-N-CA 124.418 3.412 . . . . 0.0 111.96 179.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 26.8 t-80 -53.6 143.73 36.71 Favored Pre-proline 0 CA--C 1.539 0.541 0 C-N-CA 124.496 1.118 . . . . 0.0 110.759 -173.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -71.51 6.12 2.07 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 C-N-CA 123.907 3.071 . . . . 0.0 114.879 -177.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -125.23 -5.86 7.2 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.143 1.377 . . . . 0.0 112.317 177.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.7 tt -54.98 151.55 8.69 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 119.578 1.081 . . . . 0.0 109.931 166.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 12.6 mm -127.04 140.61 48.6 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.115 0 N-CA-C 105.928 -1.879 . . . . 0.0 105.928 174.331 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 78.9 m95 -81.04 159.96 67.04 Favored Pre-proline 0 CA--C 1.537 0.459 0 O-C-N 121.938 -0.476 . . . . 0.0 110.889 177.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.77 170.68 52.84 Favored 'Cis proline' 0 N--CA 1.455 -0.751 0 C-N-CA 124.866 -0.889 . . . . 0.0 112.621 -11.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -136.61 170.91 15.29 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.073 0.949 . . . . 0.0 111.544 -179.175 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 15.7 mt -142.68 103.38 4.21 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 127.611 2.364 . . . . 0.0 108.103 -171.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.0 tp -81.1 156.1 25.95 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 118.385 -0.817 . . . . 0.0 108.82 172.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -136.87 78.05 1.68 Allowed 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 120.321 1.419 . . . . 0.0 111.425 172.63 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -45.81 119.79 2.37 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 126.236 1.814 . . . . 0.0 110.972 -169.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.68 99.37 1.67 Allowed 'General case' 0 N--CA 1.44 -0.959 0 C-N-CA 122.958 0.503 . . . . 0.0 110.382 -164.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 132.79 -46.9 1.03 Allowed Glycine 0 CA--C 1.532 1.106 0 C-N-CA 127.743 2.592 . . . . 0.0 109.625 -173.17 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 74.9 m -68.33 -33.57 74.54 Favored 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 126.646 1.978 . . . . 0.0 114.319 -169.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 68.85 -27.04 0.15 Allowed 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 127.271 2.228 . . . . 0.0 114.422 -176.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -52.7 116.58 2.38 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 127.627 2.371 . . . . 0.0 109.569 169.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.529 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 4.4 mm? -73.32 136.93 44.53 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 106.908 -1.516 . . . . 0.0 106.908 168.107 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -106.73 87.07 2.58 Favored Pre-proline 0 C--O 1.239 0.529 0 C-N-CA 127.319 2.247 . . . . 0.0 108.652 -176.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -61.82 147.37 95.39 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 122.21 1.94 . . . . 0.0 109.74 176.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.2 mt -138.59 116.71 11.77 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 105.542 -2.021 . . . . 0.0 105.542 178.305 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 25.4 mtt-85 -82.16 -39.55 23.07 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 120.615 1.552 . . . . 0.0 114.305 -175.143 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.7 t -145.91 -177.04 5.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 120.367 1.439 . . . . 0.0 108.802 167.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.96 -25.77 58.49 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.39 1.876 . . . . 0.0 112.576 -178.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -68.24 -29.62 68.48 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.08 0.952 . . . . 0.0 111.212 173.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -70.28 -33.39 71.52 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 121.252 -0.905 . . . . 0.0 110.407 -176.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 46.1 t-105 -60.86 -32.97 72.38 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.754 -0.592 . . . . 0.0 111.35 170.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 -66.75 -42.77 85.63 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 118.474 0.579 . . . . 0.0 111.162 173.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? . . . . . 0 N--CA 1.47 0.537 0 CA-C-N 119.047 0.84 . . . . 0.0 110.243 179.817 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 90.3 mt . . . . . 0 C--O 1.24 0.575 0 N-CA-C 102.117 -3.29 . . . . 0.0 102.117 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -118.24 160.85 20.89 Favored 'General case' 0 C--O 1.234 0.284 0 O-C-N 123.858 0.724 . . . . 0.0 110.038 -170.633 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -66.04 124.01 21.42 Favored 'General case' 0 CA--C 1.514 -0.429 0 C-N-CA 120.161 -0.616 . . . . 0.0 109.362 -164.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 103.6 0.82 46.5 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-O 117.747 -1.585 . . . . 0.0 113.821 -176.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -55.8 -29.37 59.61 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.808 1.643 . . . . 0.0 113.797 -167.652 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 17.5 ttmt 54.97 155.08 0.01 OUTLIER 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 128.672 2.789 . . . . 0.0 114.889 -179.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.1 mt -141.87 140.82 32.99 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.089 174.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 99.0 t -134.05 120.87 36.74 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 125.322 1.449 . . . . 0.0 108.479 177.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 26.5 p30 -99.78 173.41 6.71 Favored 'General case' 0 C--N 1.329 -0.296 1 C-N-CA 132.018 4.127 . . . . 0.0 111.181 178.745 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.25 2.69 0.05 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.837 1.655 . . . . 0.0 114.65 174.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -123.44 5.14 9.02 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.921 1.688 . . . . 0.0 110.581 -174.342 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.41 ' CE2' ' HA ' ' A' ' 75' ' ' PRO . 11.7 m-85 61.82 14.88 6.59 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.188 1.795 . . . . 0.0 112.877 172.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 8.9 m170 -66.01 109.05 2.41 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 124.708 1.203 . . . . 0.0 109.713 163.235 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 97.4 m -72.15 140.15 48.66 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 118.168 -1.413 . . . . 0.0 108.43 166.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 55.1 m-85 -124.94 159.89 30.14 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-O 117.749 -1.12 . . . . 0.0 108.76 165.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 1.6 p -150.28 153.29 10.61 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.419 0 CA-C-N 120.522 1.51 . . . . 0.0 112.402 171.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 17.5 tp -77.87 131.9 37.72 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 126.071 1.748 . . . . 0.0 108.727 -177.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -105.75 174.61 5.81 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 123.74 0.816 . . . . 0.0 110.479 179.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -68.89 -2.42 9.62 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.272 -0.893 . . . . 0.0 112.927 172.559 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -85.87 0.78 52.17 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 120.369 -1.457 . . . . 0.0 112.153 165.006 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 51.87 8.94 0.07 Allowed 'General case' 0 C--O 1.237 0.426 0 C-N-CA 128.104 2.562 . . . . 0.0 113.953 -164.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -77.72 174.16 11.27 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 167.55 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 74.7 m95 -114.49 136.94 52.46 Favored 'General case' 0 N--CA 1.44 -0.944 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 -179.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -118.31 144.71 35.59 Favored Pre-proline 0 N--CA 1.45 -0.472 0 C-N-CA 126.013 1.725 . . . . 0.0 110.401 -170.305 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -79.28 101.97 1.47 Allowed 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 124.697 3.598 . . . . 0.0 110.073 -178.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -83.35 24.68 0.8 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.212 1.405 . . . . 0.0 112.625 179.432 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 67.8 165.11 0.13 Allowed Pre-proline 0 CA--C 1.543 0.679 0 C-N-CA 128.836 2.854 . . . . 0.0 111.99 -178.09 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -70.54 175.38 8.82 Favored 'Trans proline' 0 N--CA 1.452 -0.956 0 C-N-CA 121.263 1.309 . . . . 0.0 111.947 175.062 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 13.4 tp -126.6 155.36 74.9 Favored Pre-proline 0 CA--C 1.539 0.549 0 C-N-CA 126.813 2.045 . . . . 0.0 108.772 -172.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -73.14 165.67 32.07 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 121.793 1.662 . . . . 0.0 110.113 164.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.41 ' HA ' ' CE2' ' A' ' 56' ' ' PHE . 18.5 Cg_endo -59.32 -36.41 94.63 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.544 2.163 . . . . 0.0 112.459 177.767 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -78.97 -25.29 43.47 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 122.455 0.302 . . . . 0.0 110.245 -174.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.13 -24.58 67.28 Favored Glycine 0 CA--C 1.53 1.029 0 CA-C-O 119.137 -0.813 . . . . 0.0 113.189 -174.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 23.4 tp -55.09 -46.16 75.48 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 124.832 1.253 . . . . 0.0 109.962 168.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -75.39 -15.26 60.47 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 123.603 0.761 . . . . 0.0 110.632 -168.583 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -68.36 -44.84 74.34 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.063 -1.023 . . . . 0.0 110.981 164.215 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.8 mp -58.15 -56.93 15.75 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 175.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 6.0 mm -53.19 -34.19 21.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 C-N-CA 125.059 1.344 . . . . 0.0 110.986 -178.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 12.2 ttt-85 -48.02 -38.89 18.22 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 119.381 0.992 . . . . 0.0 112.559 175.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -71.37 -42.96 67.77 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.373 0.988 . . . . 0.0 111.773 -179.074 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.529 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 13.5 t60 -55.24 -55.05 35.72 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.778 0.799 . . . . 0.0 109.281 170.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 95.1 m -68.29 -29.04 67.73 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 121.324 -0.86 . . . . 0.0 111.333 -172.13 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -78.95 -24.26 44.04 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 117.373 -1.299 . . . . 0.0 112.602 178.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.4 t -92.6 -17.75 23.97 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.914 0.779 . . . . 0.0 110.821 -177.136 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 70.1 mt -107.28 -22.35 12.63 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.581 0.752 . . . . 0.0 111.877 178.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 79.96 53.83 4.09 Favored Glycine 0 C--N 1.337 0.614 0 N-CA-C 110.913 -0.875 . . . . 0.0 110.913 -177.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 35.3 m-70 . . . . . 0 C--O 1.232 0.157 0 C-N-CA 122.969 0.508 . . . . 0.0 110.673 177.052 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 7.9 m80 . . . . . 0 N--CA 1.464 0.271 0 CA-C-O 119.067 -0.492 . . . . 0.0 111.831 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 84.5 mt -150.69 154.39 37.32 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 124.519 1.128 . . . . 0.0 109.655 -159.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 16.0 t-160 -83.85 -40.01 19.2 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 124.571 1.169 . . . . 0.0 111.397 173.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 88.8 p -172.26 -175.36 1.4 Allowed 'General case' 0 C--O 1.236 0.351 0 C-N-CA 124.241 1.017 . . . . 0.0 110.414 -171.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 67.5 t -55.0 -45.27 76.67 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.291 0 C-N-CA 125.106 1.362 . . . . 0.0 110.329 177.641 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 2.8 ttm -62.29 -45.63 92.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 118.527 0.603 . . . . 0.0 110.113 -171.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.55 -39.8 85.18 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 124.559 1.144 . . . . 0.0 110.08 173.167 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.62 -53.82 51.07 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 123.691 0.796 . . . . 0.0 111.566 178.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 32.4 mm -53.86 -47.08 64.19 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 -178.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -60.12 -51.54 69.16 Favored 'General case' 0 CA--C 1.521 -0.153 0 C-N-CA 123.71 0.804 . . . . 0.0 111.163 -179.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 13.0 t80 -53.27 -65.13 0.62 Allowed 'General case' 0 C--O 1.221 -0.42 0 C-N-CA 126.371 1.868 . . . . 0.0 110.176 178.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 9.2 mp -52.29 -45.12 65.36 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 125.784 1.634 . . . . 0.0 112.015 -178.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -65.35 -33.98 77.23 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 118.668 0.667 . . . . 0.0 111.548 177.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -80.57 -18.74 47.4 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.741 0.816 . . . . 0.0 112.836 177.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 63.6 mt . . . . . 0 CA--C 1.518 -0.251 0 C-N-CA 124.317 1.047 . . . . 0.0 110.98 173.643 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.238 0.489 0 N-CA-C 111.662 0.245 . . . . 0.0 111.662 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -71.91 70.23 2.91 Favored 'Trans proline' 0 N--CA 1.45 -1.062 0 C-N-CA 123.076 2.517 . . . . 0.0 110.089 169.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . 0.496 ' HD1' ' HB2' ' A' ' 10' ' ' GLN . 1.3 t-80 75.55 148.09 0.12 Allowed Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 129.098 2.959 . . . . 0.0 113.432 -176.812 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -78.1 -28.74 4.61 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 122.688 2.259 . . . . 0.0 113.25 173.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.496 ' HB2' ' HD1' ' A' ' 8' ' ' HIS . 1.6 mm-40 -69.93 -22.34 63.2 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.701 1.137 . . . . 0.0 112.293 176.322 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 tt -63.77 135.56 56.74 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 166.368 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 3.0 tt -107.85 178.92 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.165 0 C-N-CA 124.286 1.035 . . . . 0.0 108.443 176.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 58.2 m95 -122.87 149.87 57.49 Favored Pre-proline 0 C--O 1.237 0.4 0 O-C-N 121.586 -0.696 . . . . 0.0 109.568 172.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -68.69 162.59 80.6 Favored 'Cis proline' 0 CA--C 1.542 0.917 0 N-CA-C 114.713 1.005 . . . . 0.0 114.713 -1.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -139.8 169.79 17.08 Favored 'General case' 0 CA--C 1.519 -0.219 0 C-N-CA 127.088 2.155 . . . . 0.0 110.967 -177.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -138.79 112.93 8.64 Favored 'General case' 0 N--CA 1.436 -1.164 0 C-N-CA 126.895 2.078 . . . . 0.0 108.597 -156.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 22.2 tp -99.72 151.51 21.15 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 123.772 0.67 . . . . 0.0 109.469 169.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.48 88.54 2.15 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 171.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.536 ' NE2' HE21 ' A' ' 46' ' ' GLN . 0.8 OUTLIER -52.94 138.0 31.17 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 118.195 0.452 . . . . 0.0 110.381 -171.649 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -59.02 109.92 0.93 Allowed 'General case' 0 N--CA 1.433 -1.321 0 C-N-CA 124.69 1.196 . . . . 0.0 108.364 178.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 110.09 -36.17 4.43 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 126.201 1.858 . . . . 0.0 112.825 -179.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 1.8 p -69.45 171.27 9.0 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 119.661 1.731 . . . . 0.0 109.151 177.083 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 11.5 m-80 -116.8 -16.49 10.62 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.622 -1.172 . . . . 0.0 108.883 172.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -76.83 109.59 10.75 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 124.359 1.064 . . . . 0.0 108.851 -170.286 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -68.74 137.22 53.88 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 108.164 -1.051 . . . . 0.0 108.164 172.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -107.05 88.41 3.7 Favored Pre-proline 0 C--N 1.327 -0.391 0 C-N-CA 128.844 2.858 . . . . 0.0 112.786 -170.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -66.39 120.79 7.96 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 122.194 1.929 . . . . 0.0 111.28 174.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -111.99 107.78 16.87 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 126.805 2.042 . . . . 0.0 106.074 168.102 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 4.4 mtt-85 -59.73 -49.55 77.29 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.093 0.557 . . . . 0.0 110.206 178.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 22.3 p -140.4 174.68 10.28 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 123.348 0.659 . . . . 0.0 109.642 178.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -56.55 -36.41 69.24 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 124.543 1.137 . . . . 0.0 111.479 178.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.5 -30.93 71.97 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-N 118.959 0.8 . . . . 0.0 110.177 -177.617 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -69.1 -40.6 78.3 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-N 119.43 1.014 . . . . 0.0 111.197 174.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 13.0 t-105 -56.7 -43.32 80.4 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.254 0.622 . . . . 0.0 110.514 175.128 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -62.6 -55.95 22.36 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 174.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.466 0.337 0 C-N-CA 124.085 0.954 . . . . 0.0 112.726 -173.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 56.6 mt . . . . . 0 N--CA 1.456 -0.144 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.536 HE21 ' NE2' ' A' ' 19' ' ' GLN . 43.6 mt-30 -118.53 140.96 49.05 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 125.223 1.409 . . . . 0.0 108.363 -179.14 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.423 ' HA ' ' HB3' ' A' ' 61' ' ' LEU . 43.1 m-85 -63.79 108.99 1.58 Allowed 'General case' 0 C--O 1.234 0.259 0 N-CA-C 107.051 -1.463 . . . . 0.0 107.051 170.741 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 131.8 -12.58 5.36 Favored Glycine 0 CA--C 1.527 0.791 0 CA-C-O 118.919 -0.934 . . . . 0.0 112.866 -178.335 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -60.22 -10.76 4.93 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 127.134 2.173 . . . . 0.0 115.914 -166.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.6 ttmt 54.18 124.31 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 129.763 3.225 . . . . 0.0 114.786 175.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -99.62 149.94 22.76 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 161.217 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 24.1 t -128.98 152.3 36.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 C-N-CA 128.327 2.651 . . . . 0.0 105.189 164.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -133.5 179.41 6.23 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.216 1.406 . . . . 0.0 110.86 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.4 m -70.28 -10.69 59.68 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 178.459 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 62.8 m-80 -85.94 -3.46 58.93 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 124.347 1.059 . . . . 0.0 111.356 170.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 60.55 23.25 12.96 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.226 1.01 . . . . 0.0 110.157 -170.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 49.2 m170 -75.34 114.42 13.86 Favored 'General case' 0 C--O 1.232 0.176 0 O-C-N 120.655 -1.278 . . . . 0.0 109.035 167.043 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 23.2 m -78.43 153.17 31.72 Favored 'General case' 0 C--O 1.239 0.5 0 N-CA-C 108.334 -0.988 . . . . 0.0 108.334 169.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -139.45 152.26 46.88 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.759 1.624 . . . . 0.0 107.861 171.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 63.0 t -136.29 144.25 33.52 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 127.848 2.459 . . . . 0.0 106.927 175.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.423 ' HB3' ' HA ' ' A' ' 47' ' ' TYR . 0.5 OUTLIER -81.02 134.41 35.67 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 127.331 2.252 . . . . 0.0 110.034 -178.493 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -109.97 168.48 9.4 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.729 1.15 . . . . 0.0 111.594 174.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -61.3 -15.09 31.92 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 120.384 -1.447 . . . . 0.0 112.876 178.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.05 -2.0 22.47 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 126.591 1.957 . . . . 0.0 112.63 171.66 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 74.4 -12.16 0.93 Allowed 'General case' 0 C--N 1.346 0.427 0 C-N-CA 127.009 2.124 . . . . 0.0 111.653 -175.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.2 p-80 -75.21 156.86 35.35 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 119.348 0.976 . . . . 0.0 112.054 177.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 65.9 m95 -104.08 96.19 6.49 Favored 'General case' 0 N--CA 1.436 -1.139 0 N-CA-C 105.211 -2.144 . . . . 0.0 105.211 174.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -81.54 161.26 62.34 Favored Pre-proline 0 C--O 1.239 0.543 0 C-N-CA 124.06 0.944 . . . . 0.0 109.847 177.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -74.34 148.95 39.28 Favored 'Trans proline' 0 N--CA 1.449 -1.095 0 C-N-CA 122.722 2.281 . . . . 0.0 109.136 -175.29 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -138.89 37.03 2.16 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.172 0.989 . . . . 0.0 110.757 -171.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 65.32 164.42 0.12 Allowed Pre-proline 0 CA--C 1.541 0.618 0 C-N-CA 129.001 2.92 . . . . 0.0 113.096 -174.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -69.97 -178.6 2.5 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 121.758 1.638 . . . . 0.0 111.699 169.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.9 tt -128.38 143.72 49.24 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 125.775 1.63 . . . . 0.0 108.858 -172.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -82.87 164.96 15.59 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.679 2.919 . . . . 0.0 111.155 -176.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -60.07 -28.32 86.78 Favored 'Trans proline' 0 CA--C 1.535 0.565 0 C-N-CA 121.612 1.542 . . . . 0.0 113.15 -178.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -84.24 -20.52 32.1 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.66 0.784 . . . . 0.0 112.731 175.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.65 -26.66 70.02 Favored Glycine 0 C--N 1.341 0.82 0 CA-C-N 119.154 0.888 . . . . 0.0 111.371 -173.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 18.5 tp -61.23 -52.3 65.35 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 126.391 1.876 . . . . 0.0 108.418 175.041 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -62.93 -34.95 78.54 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 123.128 0.571 . . . . 0.0 109.969 179.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.65 -32.44 73.76 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 127.055 2.142 . . . . 0.0 112.566 178.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.5 mp -67.07 -66.69 0.53 Allowed 'General case' 0 C--O 1.233 0.208 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 165.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 12.7 mm -53.65 -29.46 17.42 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 C-N-CA 125.941 1.697 . . . . 0.0 112.048 -171.103 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.7 mtp180 -44.82 -46.7 10.83 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 126.312 1.845 . . . . 0.0 110.979 173.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.74 -47.09 85.07 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.947 0.794 . . . . 0.0 111.637 179.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -59.45 -49.36 78.1 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.872 0.869 . . . . 0.0 109.822 179.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 84.8 m -69.17 -26.53 64.9 Favored 'General case' 0 C--N 1.329 -0.287 0 O-C-N 120.972 -1.08 . . . . 0.0 111.307 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -78.41 -14.74 59.25 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.469 1.108 . . . . 0.0 113.427 177.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.5 t -98.37 -16.86 19.14 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.968 0.804 . . . . 0.0 111.488 178.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 86.8 mt -109.41 -41.49 4.6 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.468 1.107 . . . . 0.0 110.84 178.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 103.83 64.8 0.69 Allowed Glycine 0 C--N 1.334 0.426 0 C-N-CA 125.093 1.33 . . . . 0.0 111.428 -178.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 10.1 m-70 . . . . . 0 C--O 1.233 0.231 0 CA-C-O 122.373 1.082 . . . . 0.0 111.46 177.491 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 5.7 m80 . . . . . 0 CA--C 1.54 0.559 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 95.3 mt -133.59 104.91 6.59 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.427 1.491 . . . . 0.0 109.186 -164.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -45.53 -40.7 8.9 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 127.877 2.471 . . . . 0.0 114.691 178.367 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 34.6 t -161.16 165.94 28.68 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 -168.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 45.5 t -61.64 -42.88 95.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 175.513 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 4.5 ttm -56.51 -44.89 81.17 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 123.752 0.821 . . . . 0.0 111.58 177.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.54 -38.42 87.1 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 110.395 -0.224 . . . . 0.0 110.395 177.865 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.98 -36.32 74.67 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 118.302 -0.856 . . . . 0.0 112.269 175.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.4 mm -57.46 -57.72 9.01 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.13 0 CA-C-N 119.389 0.995 . . . . 0.0 108.629 177.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.65 -20.97 52.88 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 118.64 0.655 . . . . 0.0 112.677 -169.416 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -55.94 -61.64 2.24 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 164.001 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 73.1 mt -63.57 -37.44 87.33 Favored 'General case' 0 C--O 1.232 0.141 0 C-N-CA 122.725 0.41 . . . . 0.0 110.699 -175.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -64.34 -17.6 63.86 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -176.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -100.38 -5.66 26.91 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.735 1.214 . . . . 0.0 113.462 -179.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 62.7 mt . . . . . 0 CA--C 1.534 0.329 0 CA-C-N 118.58 0.627 . . . . 0.0 110.479 173.43 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.536 0.425 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -64.59 -31.88 59.34 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 121.76 1.64 . . . . 0.0 111.512 -177.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . 0.545 ' HD1' ' HB2' ' A' ' 10' ' ' GLN . 4.1 t-80 -160.58 156.42 22.27 Favored Pre-proline 0 CA--C 1.538 0.503 0 CA-C-O 117.537 -1.22 . . . . 0.0 108.916 178.269 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -83.71 -25.14 2.56 Favored 'Trans proline' 0 CA--C 1.536 0.59 0 C-N-CA 122.566 2.178 . . . . 0.0 112.959 171.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.545 ' HB2' ' HD1' ' A' ' 8' ' ' HIS . 7.4 mm100 -64.84 -18.71 65.37 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.55 1.068 . . . . 0.0 111.703 170.445 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 tt -77.81 123.24 26.48 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.161 0.984 . . . . 0.0 109.18 175.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.408 ' CG1' HD22 ' A' ' 55' ' ' ASN . 48.1 mm -123.59 108.57 21.2 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 N-CA-C 106.625 -1.62 . . . . 0.0 106.625 -179.451 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 82.6 m95 -53.83 155.49 5.94 Favored Pre-proline 0 C--O 1.237 0.431 0 C-N-CA 124.983 1.313 . . . . 0.0 113.427 -177.158 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -68.42 169.37 57.24 Favored 'Cis proline' 0 CA--C 1.534 0.493 0 N-CA-C 113.965 0.717 . . . . 0.0 113.965 -2.348 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -137.21 168.39 19.71 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 123.846 0.858 . . . . 0.0 110.79 177.216 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 14.3 mt -136.73 108.91 7.24 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 126.805 2.042 . . . . 0.0 107.242 -175.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.7 tp -81.01 144.36 31.84 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.633 -0.876 . . . . 0.0 108.633 174.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.15 94.06 2.41 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-N 118.571 0.623 . . . . 0.0 109.77 168.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -57.09 149.89 18.41 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 121.246 0.546 . . . . 0.0 110.328 -179.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -64.08 -10.04 19.94 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 171.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -109.06 0.5 31.52 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 125.831 1.681 . . . . 0.0 114.299 -175.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -142.82 178.41 7.67 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 120.176 1.988 . . . . 0.0 110.944 177.836 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -121.66 -14.07 8.22 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 124.761 1.225 . . . . 0.0 109.163 176.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -65.71 117.16 7.74 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 107.467 -1.308 . . . . 0.0 107.467 175.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.444 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 3.6 mm? -74.41 136.83 42.39 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 106.897 -1.52 . . . . 0.0 106.897 168.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -110.34 87.03 5.8 Favored Pre-proline 0 C--O 1.237 0.399 0 C-N-CA 125.704 1.602 . . . . 0.0 108.491 -173.131 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -65.31 136.65 48.14 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 123.454 2.769 . . . . 0.0 110.049 -178.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.5 mt -132.93 98.26 4.25 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 -178.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.9 mmt85 -50.96 -44.11 60.51 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.487 1.515 . . . . 0.0 111.317 -177.095 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 14.4 t -160.9 -177.59 6.24 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 121.444 0.64 . . . . 0.0 109.385 -177.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -50.38 -38.83 44.66 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 125.537 1.535 . . . . 0.0 110.886 175.644 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -62.35 -33.02 73.9 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.941 0.897 . . . . 0.0 112.243 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.12 -40.15 75.04 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 121.393 -0.817 . . . . 0.0 109.607 174.509 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 47.6 t-105 -63.39 -34.03 76.84 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.214 0.606 . . . . 0.0 111.303 175.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -59.63 -62.24 2.03 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 169.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 13.2 mtt85 . . . . . 0 C--O 1.226 -0.163 0 C-N-CA 124.138 0.975 . . . . 0.0 113.548 -174.841 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.4 mt . . . . . 0 C--O 1.237 0.405 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 -143.54 151.57 40.39 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 124.259 1.024 . . . . 0.0 111.276 -167.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -63.81 115.94 5.29 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 168.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 118.93 -0.17 14.95 Favored Glycine 0 CA--C 1.527 0.835 0 CA-C-O 118.71 -1.05 . . . . 0.0 113.136 -173.027 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -65.32 -20.62 66.49 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 115.627 1.714 . . . . 0.0 115.627 -164.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 10.5 ttmt 44.49 137.08 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 131.385 3.874 . . . . 0.0 117.26 178.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 14.3 mt -125.65 161.94 26.12 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 114.804 -1.089 . . . . 0.0 109.392 167.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 95.2 t -132.38 151.78 35.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 105.533 -2.025 . . . . 0.0 105.533 158.319 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -125.51 -179.47 4.64 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 126.201 1.8 . . . . 0.0 110.828 179.079 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.3 m -64.69 -17.2 63.88 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 178.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.408 HD22 ' CG1' ' A' ' 12' ' ' ILE . 72.3 m-80 -77.03 -10.71 59.55 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 117.995 -1.002 . . . . 0.0 111.964 171.053 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 64.76 21.55 12.4 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 125.657 1.583 . . . . 0.0 111.658 -167.437 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 52.3 m170 -74.53 110.32 8.73 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 106.435 -1.691 . . . . 0.0 106.435 167.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 58.6 m -71.79 151.81 43.2 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 165.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 46.1 m-85 -143.33 160.67 40.1 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 126.461 1.905 . . . . 0.0 108.076 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 2.2 p -154.92 152.34 9.43 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.341 0 CA-C-N 120.741 1.609 . . . . 0.0 111.372 169.481 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 17.1 tp -77.98 144.01 37.11 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 125.396 1.478 . . . . 0.0 108.215 -179.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -120.67 168.19 11.66 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 125.559 1.544 . . . . 0.0 110.062 -172.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -59.64 -31.15 69.25 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 125.321 1.449 . . . . 0.0 110.841 178.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.2 2.87 11.95 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 123.619 0.767 . . . . 0.0 112.473 175.028 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 55.51 18.77 2.84 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 128.937 2.895 . . . . 0.0 113.755 176.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -84.82 -177.16 6.51 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 124.659 1.184 . . . . 0.0 108.549 154.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 50.6 m95 -112.31 154.54 25.54 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 171.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -124.7 150.85 66.68 Favored Pre-proline 0 C--O 1.236 0.374 0 C-N-CA 124.925 1.29 . . . . 0.0 110.221 175.686 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -71.24 111.79 3.17 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 123.75 2.967 . . . . 0.0 109.99 176.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.46 34.87 0.33 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.685 1.194 . . . . 0.0 110.807 171.326 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.83 166.64 0.12 Allowed Pre-proline 0 CA--C 1.545 0.785 0 C-N-CA 125.927 1.691 . . . . 0.0 112.131 -179.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -70.57 176.22 7.69 Favored 'Trans proline' 0 CA--C 1.535 0.571 0 C-N-CA 121.219 1.279 . . . . 0.0 111.076 166.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 20.6 tp -131.43 144.58 54.01 Favored Pre-proline 0 CA--C 1.536 0.441 0 C-N-CA 125.616 1.566 . . . . 0.0 109.324 -174.053 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -77.14 168.19 23.64 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 122.416 2.078 . . . . 0.0 109.555 176.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -59.05 -47.08 19.05 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 122.275 1.983 . . . . 0.0 112.367 178.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -79.16 -6.08 55.71 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 119.482 1.037 . . . . 0.0 110.108 -177.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.6 -24.45 67.92 Favored Glycine 0 CA--C 1.534 1.243 0 CA-C-O 118.841 -0.977 . . . . 0.0 112.972 164.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 25.6 tp -59.2 -48.08 82.94 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.588 1.694 . . . . 0.0 108.916 178.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -67.51 -7.5 26.3 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 125.421 1.488 . . . . 0.0 112.34 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -82.69 -34.94 27.2 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 121.148 1.795 . . . . 0.0 111.251 168.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -66.96 -70.76 0.23 Allowed 'General case' 0 N--CA 1.457 -0.114 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 178.19 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 34.0 mm -57.53 -21.03 15.02 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 C-N-CA 123.102 0.561 . . . . 0.0 112.219 -174.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.87 -47.84 11.13 Favored 'General case' 0 C--N 1.343 0.286 0 C-N-CA 124.3 1.04 . . . . 0.0 111.716 172.159 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.79 -48.85 70.38 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.23 0.612 . . . . 0.0 109.952 -171.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.444 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 10.5 t60 -55.31 -49.32 72.46 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 126.036 1.734 . . . . 0.0 110.01 175.713 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 90.0 m -61.64 -46.41 89.89 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.463 179.063 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.55 -40.4 94.56 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 118.877 0.762 . . . . 0.0 112.33 -178.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.4 t -78.59 7.0 7.46 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.025 0.53 . . . . 0.0 111.753 178.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.5 mt -126.83 -21.99 3.94 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.005 -1.059 . . . . 0.0 111.35 173.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 97.9 6.8 56.91 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 126.378 1.942 . . . . 0.0 113.997 -176.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 81.3 m-70 . . . . . 0 C--O 1.237 0.437 0 CA-C-N 119.404 1.602 . . . . 0.0 110.71 -174.093 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.535 0.402 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 95.0 mt -145.39 171.44 14.61 Favored 'General case' 0 C--O 1.225 -0.184 0 C-N-CA 127.478 2.311 . . . . 0.0 108.503 -166.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 27.2 t-80 -131.06 -29.56 1.84 Allowed 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 125.066 1.346 . . . . 0.0 110.135 -172.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 5.1 m -173.45 170.53 4.15 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.731 1.612 . . . . 0.0 108.681 -175.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 70.5 t -59.62 -44.0 92.39 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 172.149 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 3.4 tpt -47.34 -54.35 11.32 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.12 0.968 . . . . 0.0 109.377 174.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.63 -29.56 70.78 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.536 0.734 . . . . 0.0 112.184 -175.572 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -69.61 -48.67 59.29 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.553 1.141 . . . . 0.0 110.417 175.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 11.5 mm -59.74 -32.66 50.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 123.99 0.916 . . . . 0.0 109.723 178.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -69.0 -50.15 51.44 Favored 'General case' 0 C--N 1.338 0.091 0 C-N-CA 123.501 0.72 . . . . 0.0 110.437 175.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -54.84 -60.81 2.86 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 125.92 1.688 . . . . 0.0 111.105 178.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.8 mp -52.24 -40.92 62.29 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.412 1.085 . . . . 0.0 112.627 -179.242 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 20.5 m-80 -72.45 -28.54 63.0 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 118.881 0.764 . . . . 0.0 112.718 176.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -76.95 -27.53 54.85 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 121.353 -0.842 . . . . 0.0 111.296 177.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 40.5 mt . . . . . 0 CA--C 1.522 -0.107 0 C-N-CA 123.656 0.782 . . . . 0.0 109.401 179.729 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.24 0.577 0 CA-C-O 118.453 -0.784 . . . . 0.0 109.863 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -65.59 -47.42 4.11 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 122.262 1.975 . . . . 0.0 111.881 -177.704 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -146.58 145.94 25.15 Favored Pre-proline 0 C--O 1.234 0.281 0 N-CA-C 106.745 -1.576 . . . . 0.0 106.745 170.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -73.96 -34.6 5.01 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.15 1.9 . . . . 0.0 111.348 175.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -76.29 -7.75 55.6 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.994 1.317 . . . . 0.0 113.062 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.1 tt -60.05 107.73 0.67 Allowed 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.236 1.015 . . . . 0.0 108.742 170.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 33.3 mm -83.9 100.2 7.13 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 172.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 64.5 m95 -56.14 155.31 12.82 Favored Pre-proline 0 CA--C 1.544 0.72 0 O-C-N 121.486 -0.759 . . . . 0.0 111.696 178.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -67.79 169.34 53.82 Favored 'Cis proline' 0 N--CA 1.459 -0.544 0 C-N-CA 125.425 -0.656 . . . . 0.0 113.468 -4.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -135.64 170.24 16.28 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.515 0.726 . . . . 0.0 111.059 176.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 mt -136.96 106.9 6.27 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 126.951 2.1 . . . . 0.0 106.203 178.618 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.3 tp -70.26 146.87 50.34 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 105.597 -2.001 . . . . 0.0 105.597 161.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.27 88.48 2.02 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 173.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -61.41 158.11 15.38 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 123.1 1.428 . . . . 0.0 112.417 -158.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.27 134.93 40.98 Favored 'General case' 0 N--CA 1.431 -1.416 0 N-CA-C 105.598 -2.001 . . . . 0.0 105.598 178.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 88.69 -54.79 4.11 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 125.162 1.363 . . . . 0.0 111.137 -175.046 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.436 ' C ' ' H ' ' A' ' 24' ' ' GLU . 0.9 OUTLIER -80.09 -13.65 59.12 Favored 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 115.327 1.603 . . . . 0.0 115.327 -159.521 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.5 m-80 64.47 -20.18 0.07 Allowed 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 121.664 2.029 . . . . 0.0 114.298 175.33 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.436 ' H ' ' C ' ' A' ' 22' ' ' CYS . 28.8 tt0 -73.48 154.81 39.76 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 127.665 2.386 . . . . 0.0 109.525 178.757 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.9 mt -104.17 155.23 18.89 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 125.262 1.425 . . . . 0.0 109.147 -178.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -124.5 86.36 55.31 Favored Pre-proline 0 CA--C 1.538 0.506 0 C-N-CA 124.997 1.319 . . . . 0.0 108.975 177.014 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -68.68 114.82 3.65 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 124.509 3.473 . . . . 0.0 111.512 -177.667 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.8 mt -116.62 104.9 11.85 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 124.997 1.319 . . . . 0.0 108.447 -173.143 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -58.57 -44.7 89.85 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.22 0.533 . . . . 0.0 111.737 -177.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.3 p -151.44 174.47 13.33 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 124.878 1.271 . . . . 0.0 108.937 -162.301 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -69.38 -27.76 65.6 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 119.921 -0.712 . . . . 0.0 111.604 174.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -56.55 -32.8 65.49 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.298 0.954 . . . . 0.0 110.131 169.048 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -68.27 -42.98 78.79 Favored 'General case' 0 C--O 1.223 -0.302 0 O-C-N 120.988 -1.07 . . . . 0.0 110.05 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 31.3 t-105 -59.53 -32.19 70.08 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.514 -0.741 . . . . 0.0 112.02 174.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -65.12 -56.44 12.94 Favored 'General case' 0 CA--C 1.52 -0.178 0 O-C-N 121.067 -1.021 . . . . 0.0 109.057 175.202 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 87.3 mtm180 . . . . . 0 C--O 1.221 -0.414 0 C-N-CA 124.073 0.949 . . . . 0.0 110.259 -179.415 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 67.5 mt . . . . . 0 CA--C 1.518 -0.263 0 N-CA-C 106.375 -1.713 . . . . 0.0 106.375 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 -109.52 149.11 30.1 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 172.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -70.16 70.62 0.39 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 126.674 1.99 . . . . 0.0 110.016 -178.181 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 160.76 2.97 0.06 OUTLIER Glycine 0 N--CA 1.439 -1.108 0 C-N-CA 123.553 0.597 . . . . 0.0 112.003 -172.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -65.35 -10.2 31.07 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 -172.412 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.7 ttmt 60.05 140.75 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 129.228 3.011 . . . . 0.0 111.997 174.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 5.7 mt -130.73 154.77 47.61 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 106.538 -1.653 . . . . 0.0 106.538 167.318 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 53.2 t -136.79 122.33 27.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 102.687 -3.079 . . . . 0.0 102.687 173.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -82.03 -165.54 1.02 Allowed 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 127.965 2.506 . . . . 0.0 112.486 167.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 83.6 p -73.06 -29.86 63.28 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 120.254 1.388 . . . . 0.0 114.043 176.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -83.18 1.47 40.44 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 126.224 1.81 . . . . 0.0 111.259 -168.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 65.46 22.7 11.89 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.615 1.966 . . . . 0.0 111.364 -173.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -66.76 112.49 4.26 Favored 'General case' 0 C--O 1.232 0.152 0 O-C-N 120.381 -1.449 . . . . 0.0 109.934 161.213 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 11.4 m -69.35 158.28 35.38 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 119.956 -0.698 . . . . 0.0 109.36 161.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -141.75 166.1 25.65 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 125.518 1.527 . . . . 0.0 109.445 172.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 34.1 t -144.46 134.44 19.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 C-N-CA 127.141 2.176 . . . . 0.0 107.209 177.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.79 135.6 37.13 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 106.605 -1.628 . . . . 0.0 106.605 167.056 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -120.02 170.61 9.12 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 119.751 1.159 . . . . 0.0 111.92 174.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -54.91 -17.29 3.48 Favored 'General case' 0 N--CA 1.468 0.467 0 O-C-N 121.034 -1.041 . . . . 0.0 112.865 175.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -72.51 -5.29 35.94 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.551 1.14 . . . . 0.0 113.592 173.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 68.89 6.78 5.79 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 126.683 1.993 . . . . 0.0 112.574 -176.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -95.12 162.47 13.7 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 119.396 0.998 . . . . 0.0 111.667 171.648 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 56.5 m95 -107.51 78.7 1.23 Allowed 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 124.979 1.312 . . . . 0.0 108.59 178.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 63.0 t-80 -60.7 144.09 89.92 Favored Pre-proline 0 CA--C 1.545 0.75 0 CA-C-O 119.136 -0.459 . . . . 0.0 110.187 -171.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.82 113.23 3.48 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 124.103 3.202 . . . . 0.0 111.097 173.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -94.13 40.43 1.08 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.857 1.663 . . . . 0.0 111.24 -179.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.91 165.25 0.13 Allowed Pre-proline 0 CA--C 1.543 0.677 0 C-N-CA 127.856 2.462 . . . . 0.0 113.485 175.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -68.16 171.21 12.99 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.726 2.284 . . . . 0.0 112.025 167.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.0 tp -146.95 146.15 24.96 Favored Pre-proline 0 CA--C 1.534 0.335 0 C-N-CA 124.121 0.968 . . . . 0.0 111.41 -170.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -64.75 164.47 24.1 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 123.138 2.558 . . . . 0.0 113.384 171.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -61.17 -28.75 85.74 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 123.806 3.004 . . . . 0.0 112.809 174.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -82.51 -16.99 46.69 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 121.803 -0.561 . . . . 0.0 110.941 -179.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.93 -32.18 80.21 Favored Glycine 0 CA--C 1.534 1.263 0 N-CA-C 110.926 -0.87 . . . . 0.0 110.926 177.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 23.0 tp -58.71 -52.61 64.94 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.001 -1.293 . . . . 0.0 110.059 169.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -52.39 -27.33 15.3 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.885 0.874 . . . . 0.0 113.04 -174.128 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -72.07 -42.13 66.58 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.01 0.924 . . . . 0.0 112.171 178.242 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.5 mp -61.8 -44.83 96.08 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 123.909 0.884 . . . . 0.0 110.696 173.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 49.4 mm -55.83 -50.09 70.6 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 C-N-CA 123.713 0.805 . . . . 0.0 108.949 175.429 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.97 -46.19 10.96 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 125.475 1.51 . . . . 0.0 112.448 174.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -58.49 -51.4 70.02 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 123.457 0.473 . . . . 0.0 111.049 -177.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 26.5 t60 -61.24 -46.27 91.09 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.469 1.108 . . . . 0.0 110.508 177.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 73.1 m -60.97 -46.31 91.26 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 117.54 -1.219 . . . . 0.0 110.341 -178.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.84 -31.11 68.8 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 119.851 1.205 . . . . 0.0 112.22 -176.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 15.3 t -73.25 -5.88 42.32 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 117.727 -1.13 . . . . 0.0 111.878 176.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 90.0 mt -123.51 -62.33 1.32 Allowed 'General case' 0 C--N 1.342 0.267 0 CA-C-N 120.039 1.29 . . . . 0.0 110.405 -176.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 153.61 7.22 0.09 OUTLIER Glycine 0 CA--C 1.537 1.439 0 C-N-CA 126.907 2.194 . . . . 0.0 113.224 176.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 15.5 m170 . . . . . 0 N--CA 1.468 0.439 0 CA-C-N 118.645 1.222 . . . . 0.0 109.468 -160.769 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 3.5 m80 . . . . . 0 CA--C 1.542 0.64 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 81.4 mt -137.28 158.76 43.71 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 125.895 1.678 . . . . 0.0 110.277 -160.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -120.22 -20.97 7.14 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 124.062 0.945 . . . . 0.0 110.744 -163.036 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 17.2 m -160.1 173.92 15.08 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 127.177 2.191 . . . . 0.0 108.2 170.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 41.0 t -61.11 -40.58 86.23 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.307 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 168.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 4.1 ttm -60.79 -41.67 96.04 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 118.513 0.597 . . . . 0.0 110.794 -178.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -58.22 -35.03 71.07 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-O 119.187 -0.435 . . . . 0.0 110.869 174.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.18 -39.97 93.61 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 118.721 0.691 . . . . 0.0 111.545 179.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.7 mm -59.92 -51.62 70.74 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 177.193 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -62.89 -49.26 75.52 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.366 1.066 . . . . 0.0 109.795 -176.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -55.26 -52.57 62.97 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 126.621 1.968 . . . . 0.0 111.784 179.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 41.2 mt -62.22 -37.78 86.66 Favored 'General case' 0 CA--C 1.523 -0.088 0 CA-C-N 117.679 0.218 . . . . 0.0 110.8 -172.284 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -78.38 -26.36 46.53 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 122.569 0.348 . . . . 0.0 111.38 177.026 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -74.64 -25.83 59.47 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 118.628 -0.701 . . . . 0.0 112.413 174.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 13.1 mt . . . . . 0 C--O 1.233 0.23 0 CA-C-N 118.931 0.787 . . . . 0.0 110.304 177.022 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.467 0.406 0 CA-C-O 121.169 0.509 . . . . 0.0 110.994 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -163.04 148.41 15.08 Favored Glycine 0 CA--C 1.52 0.349 0 N-CA-C 109.115 -1.594 . . . . 0.0 109.115 175.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -112.99 16.38 19.38 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 118.187 0.994 . . . . 0.0 113.487 -159.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -164.17 171.99 39.86 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 108.929 -1.668 . . . . 0.0 108.929 168.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -83.72 15.19 3.35 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.881 0.872 . . . . 0.0 110.992 -173.499 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 44.1 p -66.76 158.64 79.1 Favored Pre-proline 0 CA--C 1.537 0.449 0 C-N-CA 125.78 1.632 . . . . 0.0 111.574 -166.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -74.11 -55.1 0.09 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.113 0 C-N-CA 120.682 0.921 . . . . 0.0 110.761 -174.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -156.09 144.58 14.58 Favored Pre-proline 0 C--O 1.237 0.414 0 N-CA-C 106.091 -1.818 . . . . 0.0 106.091 -179.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -69.57 -29.52 24.66 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.053 1.835 . . . . 0.0 110.78 174.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -82.38 -15.53 52.39 Favored 'General case' 0 N--CA 1.455 -0.2 0 O-C-N 121.916 -0.49 . . . . 0.0 112.277 -171.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.6 tt -63.0 122.46 16.1 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 170.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 21.0 mm -103.09 109.25 26.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 N-CA-C 107.167 -1.42 . . . . 0.0 107.167 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 85.6 m95 -58.81 156.35 25.52 Favored Pre-proline 0 CA--C 1.542 0.644 0 C-N-CA 124.134 0.974 . . . . 0.0 111.079 179.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -66.92 170.26 45.43 Favored 'Cis proline' 0 N--CA 1.458 -0.604 0 C-N-CA 125.303 -0.707 . . . . 0.0 113.38 -4.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -136.5 168.75 18.88 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.591 0.71 . . . . 0.0 110.678 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 18.9 mt -136.01 103.57 5.4 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 125.826 1.651 . . . . 0.0 108.027 -174.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.5 tp -87.35 143.44 27.25 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 174.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.11 83.31 1.97 Allowed 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 119.992 1.269 . . . . 0.0 110.373 179.092 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -59.7 155.27 16.15 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 123.439 0.695 . . . . 0.0 111.714 -161.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.13 139.92 58.74 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-O 123.317 1.532 . . . . 0.0 108.694 -176.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 69.12 -33.65 0.31 Allowed Glycine 0 CA--C 1.533 1.177 0 C-N-CA 127.487 2.47 . . . . 0.0 113.805 -175.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 89.8 m -76.18 176.31 8.17 Favored 'General case' 0 C--O 1.24 0.59 0 CA-C-N 120.755 2.277 . . . . 0.0 111.03 177.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.5 m-80 -128.46 -22.52 3.34 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 124.858 1.263 . . . . 0.0 111.465 -176.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -66.37 111.08 3.34 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 107.929 -1.138 . . . . 0.0 107.929 -176.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.476 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 3.2 mm? -60.09 139.14 57.67 Favored 'General case' 0 CA--C 1.512 -0.506 0 N-CA-C 107.208 -1.405 . . . . 0.0 107.208 167.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -103.85 87.46 1.53 Allowed Pre-proline 0 C--N 1.324 -0.506 0 N-CA-C 104.579 -2.378 . . . . 0.0 104.579 176.567 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -62.54 140.95 84.42 Favored 'Trans proline' 0 N--CA 1.452 -0.956 0 N-CA-C 108.147 -1.521 . . . . 0.0 108.147 170.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.8 mt -138.5 100.29 4.06 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 104.614 -2.365 . . . . 0.0 104.614 -177.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 63.8 mtt180 -59.09 -35.93 74.24 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 118.352 0.524 . . . . 0.0 111.206 -175.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 15.0 t -161.66 -178.93 6.88 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 123.628 0.771 . . . . 0.0 109.018 -175.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -57.84 -28.36 64.03 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 125.497 1.519 . . . . 0.0 112.587 -179.33 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -61.52 -41.16 96.92 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.702 -0.624 . . . . 0.0 109.981 176.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -66.34 -30.84 71.32 Favored 'General case' 0 CA--C 1.522 -0.117 0 C-N-CA 123.783 0.833 . . . . 0.0 110.925 -175.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 63.5 t-105 -74.48 -43.09 57.64 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.671 0.788 . . . . 0.0 111.061 173.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -63.3 -35.44 80.38 Favored 'General case' 0 CA--C 1.528 0.13 0 O-C-N 121.698 -0.627 . . . . 0.0 110.283 176.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 63.2 mtt180 -60.76 -19.67 59.66 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.511 1.124 . . . . 0.0 112.357 173.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -64.98 -72.52 0.15 Allowed 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 120.255 1.389 . . . . 0.0 109.686 171.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 26.1 p -64.34 -20.66 66.25 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 120.882 -1.136 . . . . 0.0 113.267 -176.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.84 -28.19 69.85 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 122.985 0.514 . . . . 0.0 110.798 171.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -128.97 -16.11 4.16 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 -158.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.6 m -165.0 97.25 0.73 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 129.674 3.189 . . . . 0.0 109.95 171.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.7 mtpt -75.66 62.51 1.48 Allowed 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 125.703 1.601 . . . . 0.0 108.092 164.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -141.17 -171.76 3.35 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 125.001 1.321 . . . . 0.0 108.541 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . 0.3 16.4 mt 59.73 -157.39 0.33 Allowed 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 124.866 1.266 . . . . 0.0 111.975 -178.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.8 mt 75.22 84.11 0.1 Allowed 'General case' 0 CA--C 1.511 -0.529 0 C-N-CA 127.008 2.123 . . . . 0.0 109.826 162.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -88.63 152.0 22.11 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 113.779 -1.555 . . . . 0.0 109.577 -175.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.421 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 1.4 m-85 -71.54 93.27 1.19 Allowed 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 173.584 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 141.85 -5.27 2.24 Favored Glycine 0 N--CA 1.443 -0.891 0 CA-C-O 117.824 -1.542 . . . . 0.0 113.816 -163.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.55 -7.49 44.25 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 116.684 2.105 . . . . 0.0 116.684 -164.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.0 tppt? 44.65 130.89 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 131.405 3.882 . . . . 0.0 116.213 -174.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.1 mt -117.52 152.52 34.92 Favored 'General case' 0 C--N 1.331 -0.238 0 O-C-N 120.776 -1.202 . . . . 0.0 107.995 164.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 54.1 t -133.82 141.49 43.92 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 105.817 -1.919 . . . . 0.0 105.817 167.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -109.49 174.84 5.68 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 125.489 1.516 . . . . 0.0 110.448 175.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.2 m -60.89 -17.11 48.69 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -179.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -98.03 11.08 38.75 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.836 1.254 . . . . 0.0 111.308 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 64.54 24.75 13.12 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.023 1.729 . . . . 0.0 111.987 176.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 32.8 m80 -75.65 114.97 14.83 Favored 'General case' 0 C--N 1.332 -0.186 0 O-C-N 120.43 -1.418 . . . . 0.0 107.711 166.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.3 m -73.1 153.86 40.63 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 122.129 0.966 . . . . 0.0 108.949 161.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -140.33 157.54 45.39 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 126.359 1.864 . . . . 0.0 106.846 171.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 79.0 t -129.0 148.79 33.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 106.155 -1.794 . . . . 0.0 106.155 167.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 18.3 tp -86.93 144.14 27.08 Favored 'General case' 0 CA--C 1.521 -0.163 0 C-N-CA 125.925 1.69 . . . . 0.0 109.137 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -116.03 165.19 13.4 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 124.402 1.081 . . . . 0.0 110.359 -175.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.421 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 0.1 OUTLIER -68.18 -14.49 63.02 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 173.798 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -81.02 16.14 1.6 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.581 1.553 . . . . 0.0 111.823 173.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 45.78 37.36 3.38 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 126.854 2.062 . . . . 0.0 112.411 -178.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.1 p-80 -125.6 170.28 11.64 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 172.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 62.4 m95 -111.71 127.57 55.82 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 107.203 -1.406 . . . . 0.0 107.203 175.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -97.76 145.79 30.34 Favored Pre-proline 0 CA--C 1.537 0.481 0 C-N-CA 123.975 0.91 . . . . 0.0 108.966 178.201 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.26 116.01 4.52 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 123.376 2.717 . . . . 0.0 110.881 175.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -117.87 57.37 0.83 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.863 1.665 . . . . 0.0 109.568 -170.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.11 156.24 0.14 Allowed Pre-proline 0 CA--C 1.538 0.497 0 C-N-CA 129.731 3.213 . . . . 0.0 114.147 178.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -72.07 169.85 20.4 Favored 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 121.765 1.643 . . . . 0.0 110.355 161.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 11.3 tp -126.21 144.66 49.82 Favored Pre-proline 0 N--CA 1.451 -0.42 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.922 -167.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -69.95 165.28 31.72 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 121.614 1.542 . . . . 0.0 111.52 176.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -56.47 -31.11 84.79 Favored 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 123.434 2.756 . . . . 0.0 113.388 174.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -81.72 -15.96 52.7 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.278 1.031 . . . . 0.0 112.242 176.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -76.75 -22.15 72.83 Favored Glycine 0 CA--C 1.527 0.794 0 O-C-N 121.763 -0.586 . . . . 0.0 112.104 -174.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 29.7 tp -63.49 -48.53 77.24 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 121.694 -0.886 . . . . 0.0 109.6 164.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -53.86 -37.77 64.0 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 118.695 -0.669 . . . . 0.0 111.479 175.266 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -60.4 -34.38 73.84 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.564 1.075 . . . . 0.0 113.053 177.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.9 mp -67.8 -64.07 0.93 Allowed 'General case' 0 N--CA 1.456 -0.127 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 172.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.9 mm -60.58 -26.96 39.31 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 C-N-CA 123.681 0.792 . . . . 0.0 111.538 -170.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -44.98 -41.62 7.5 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 125.415 1.486 . . . . 0.0 110.905 168.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.56 -63.58 1.09 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.771 1.228 . . . . 0.0 111.522 176.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.476 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 7.4 t60 -55.77 -40.1 72.15 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.368 1.067 . . . . 0.0 111.267 -177.222 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 23.7 m -68.46 -51.81 39.5 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 120.38 -1.45 . . . . 0.0 110.301 177.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.74 -33.24 75.42 Favored 'General case' 0 C--N 1.339 0.137 0 CA-C-N 119.099 0.863 . . . . 0.0 111.887 -175.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.3 t -71.13 -28.41 64.27 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 118.403 -0.808 . . . . 0.0 109.302 -176.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 98.1 mt -88.4 -56.68 3.21 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 124.478 1.111 . . . . 0.0 110.858 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 142.99 9.45 0.51 Allowed Glycine 0 CA--C 1.532 1.118 0 CA-C-O 117.96 -1.467 . . . . 0.0 114.38 -172.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 7.3 m-70 -95.28 152.5 18.32 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 120.456 2.128 . . . . 0.0 111.877 -173.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 1.8 t -155.49 89.57 1.2 Allowed 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 125.46 1.504 . . . . 0.0 109.311 169.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 21.2 p 46.57 174.47 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.461 1 C-N-CA 131.949 4.1 . . . . 0.0 117.356 176.115 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 9.4 t -167.53 76.76 0.16 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 128.154 2.582 . . . . 0.0 106.981 -175.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.9 t 72.02 145.64 0.07 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 127.565 2.346 . . . . 0.0 112.444 -175.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.442 ' HE3' ' HB2' ' A' ' 100' ' ' HIS . 7.4 ttpt 62.85 177.59 0.15 Allowed 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 126.289 1.835 . . . . 0.0 111.856 -175.005 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 7.7 ptm -75.98 62.13 1.59 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.888 1.675 . . . . 0.0 112.022 -171.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 65.35 -72.49 0.07 Allowed 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 126.029 1.732 . . . . 0.0 110.276 -168.666 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 77.7 mt -147.4 134.71 20.64 Favored 'General case' 0 CA--C 1.512 -0.499 0 C-N-CA 124.947 1.299 . . . . 0.0 107.664 -174.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . 0.442 ' HB2' ' HE3' ' A' ' 96' ' ' LYS . 51.9 t-80 -61.92 -48.08 82.05 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 122.04 0.924 . . . . 0.0 110.536 178.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 2.8 m -164.82 -178.17 5.11 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.767 1.227 . . . . 0.0 111.296 -169.07 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 63.2 t -64.54 -38.24 82.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 CA-C-O 118.47 -0.776 . . . . 0.0 110.659 -176.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.01 -50.44 61.37 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 119.257 0.935 . . . . 0.0 109.122 177.002 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -65.53 -36.29 83.36 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.858 1.263 . . . . 0.0 110.307 -175.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.3 -48.5 81.09 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.999 0.519 . . . . 0.0 110.48 176.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 20.2 mm -65.24 -28.35 44.34 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 -178.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -69.8 -48.4 59.27 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.198 -0.939 . . . . 0.0 109.415 173.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -57.79 -65.11 0.69 Allowed 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 125.781 1.632 . . . . 0.0 111.629 -179.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.4 mp -49.23 -33.95 13.83 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 126.237 1.815 . . . . 0.0 113.914 -175.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -62.18 -44.99 95.38 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 118.141 0.428 . . . . 0.0 112.049 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -82.52 -8.68 59.61 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -173.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . 0.275 3.2 tp -88.37 -50.54 6.26 Favored 'General case' 0 N--CA 1.4 -2.948 0 C-N-CA 128.352 2.661 . . . . 0.0 107.51 -179.441 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -67.15 154.38 41.39 Favored 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 124.064 0.852 . . . . 0.0 111.19 -161.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.091 0 CA-C-O 117.409 -1.773 . . . . 0.0 112.208 -172.926 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 38.9 tpp . . . . . 0 N--CA 1.466 0.364 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -169.14 -127.79 0.95 Allowed Glycine 0 N--CA 1.445 -0.762 0 N-CA-C 104.644 -3.383 . . . . 0.0 104.644 173.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -60.24 155.58 17.28 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 123.223 0.609 . . . . 0.0 110.579 169.014 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -118.93 101.25 0.86 Allowed Glycine 0 C--N 1.33 0.249 0 N-CA-C 106.871 -2.492 . . . . 0.0 106.871 170.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 -127.44 20.74 6.69 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.623 1.969 . . . . 0.0 109.535 177.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 20.6 p -141.52 153.24 65.26 Favored Pre-proline 0 CA--C 1.535 0.386 0 C-N-CA 124.902 1.281 . . . . 0.0 110.775 -162.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.98 -55.48 0.31 Allowed 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 120.928 1.086 . . . . 0.0 111.697 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -160.82 143.78 9.69 Favored Pre-proline 0 CA--C 1.534 0.362 0 CA-C-N 119.485 1.039 . . . . 0.0 110.29 -173.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -73.84 -23.49 16.43 Favored 'Trans proline' 0 CA--C 1.531 0.372 0 C-N-CA 121.446 1.431 . . . . 0.0 113.56 -176.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 -72.25 -28.74 63.34 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-O 116.899 -1.524 . . . . 0.0 111.974 172.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.5 tt -56.33 123.59 15.14 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 120.106 1.321 . . . . 0.0 110.939 -173.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 28.0 mm -106.25 97.19 5.31 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.145 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 -177.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.428 ' CH2' ' HB2' ' A' ' 34' ' ' TRP . 81.5 m95 -51.16 144.06 15.63 Favored Pre-proline 0 C--O 1.236 0.391 0 O-C-N 123.761 0.663 . . . . 0.0 111.057 174.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -75.87 169.71 73.77 Favored 'Cis proline' 0 N--CA 1.458 -0.58 0 N-CA-C 114.142 0.785 . . . . 0.0 114.142 8.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -138.02 171.33 14.57 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 121.282 0.563 . . . . 0.0 111.496 175.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 19.3 mt -137.58 109.17 6.99 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 125.966 1.706 . . . . 0.0 108.067 -173.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 13.4 tp -94.41 137.79 33.13 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.549 1.139 . . . . 0.0 108.678 175.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -130.88 84.89 2.22 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.678 1.126 . . . . 0.0 110.959 179.342 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -46.21 132.43 9.88 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 126.982 2.113 . . . . 0.0 110.004 -175.237 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -60.71 127.68 32.84 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 122.601 1.191 . . . . 0.0 110.117 177.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 99.06 -49.53 1.23 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 126.295 1.902 . . . . 0.0 110.106 -174.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 57.1 m -67.99 169.26 10.32 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 122.831 1.3 . . . . 0.0 111.11 -178.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -129.41 -30.59 2.12 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 125.346 1.459 . . . . 0.0 108.935 -178.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -72.83 98.62 2.47 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 126.538 1.935 . . . . 0.0 108.579 -172.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.463 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 2.0 mm? -53.87 152.29 5.71 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 123.638 0.775 . . . . 0.0 110.918 -173.365 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -105.54 86.61 1.82 Allowed Pre-proline 0 C--O 1.235 0.306 0 C-N-CA 124.907 1.283 . . . . 0.0 108.197 172.26 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -66.94 142.74 63.51 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 121.832 1.688 . . . . 0.0 109.139 168.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.7 mt -145.86 109.32 4.71 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 -179.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.8 mmt85 -60.04 -47.7 84.75 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 123.644 0.777 . . . . 0.0 110.571 -176.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 45.3 p -139.86 174.64 10.31 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 124.135 0.974 . . . . 0.0 109.306 -172.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.75 -20.87 66.09 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.96 0.504 . . . . 0.0 111.486 173.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 48.1 m-20 -55.52 -42.5 74.62 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 123.794 0.838 . . . . 0.0 108.766 171.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -81.75 -29.64 32.77 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 123.14 0.576 . . . . 0.0 111.672 -173.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.428 ' HB2' ' CH2' ' A' ' 13' ' ' TRP . 44.7 t-105 -56.88 -45.49 82.49 Favored 'General case' 0 CA--C 1.528 0.129 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 169.537 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 66.2 mm-40 -64.33 -47.65 78.56 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 123.047 0.539 . . . . 0.0 110.367 174.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 28.1 mtt180 -53.25 -27.05 20.39 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 118.164 -0.922 . . . . 0.0 113.43 178.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -60.3 -60.68 3.42 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 120.378 1.444 . . . . 0.0 110.564 175.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 6.0 p -73.92 -30.78 62.76 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 122.823 0.449 . . . . 0.0 111.183 -172.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -68.75 -17.25 64.01 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 125.543 1.537 . . . . 0.0 111.918 175.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -126.91 28.37 5.83 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.073 0.949 . . . . 0.0 111.834 -177.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 4.4 m 52.31 27.27 4.65 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.88 1.272 . . . . 0.0 114.179 168.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.6 mmtm -48.28 -60.91 2.29 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.006 1.322 . . . . 0.0 112.676 -168.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -153.54 -176.79 5.97 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 178.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.83 178.99 0.94 Allowed 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.823 0.849 . . . . 0.0 110.879 169.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 85.2 mt -131.27 117.11 18.5 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 105.244 -2.132 . . . . 0.0 105.244 165.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -117.12 152.0 35.65 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 125.469 1.508 . . . . 0.0 108.731 -177.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.416 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 11.7 m-85 -58.06 138.27 56.17 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 107.092 -1.448 . . . . 0.0 107.092 167.311 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.75 3.18 80.79 Favored Glycine 0 CA--C 1.529 0.962 0 CA-C-O 117.55 -1.694 . . . . 0.0 114.872 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -65.97 -10.66 41.37 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 120.231 2.016 . . . . 0.0 115.154 -170.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 53.68 127.92 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 129.67 3.188 . . . . 0.0 115.443 176.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 13.0 mt -113.21 157.24 21.98 Favored 'General case' 0 C--N 1.328 -0.363 0 O-C-N 121.007 -1.058 . . . . 0.0 108.45 165.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 47.7 t -146.05 138.32 20.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 C-N-CA 128.379 2.672 . . . . 0.0 104.146 177.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.8 p-10 -118.15 -179.1 3.67 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 124.725 1.21 . . . . 0.0 111.347 177.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.64 -7.7 16.54 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 177.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -100.75 5.29 43.57 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.787 1.635 . . . . 0.0 111.54 174.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 59.06 20.27 8.13 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.343 1.457 . . . . 0.0 111.402 -178.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 49.5 m170 -72.35 111.77 7.83 Favored 'General case' 0 C--O 1.233 0.232 0 O-C-N 120.283 -1.511 . . . . 0.0 107.789 171.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -78.65 147.78 33.45 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 175.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -142.64 143.65 32.45 Favored 'General case' 0 N--CA 1.435 -1.222 0 CA-C-N 113.114 -1.857 . . . . 0.0 107.248 -172.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 55.5 t -127.94 146.99 32.66 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 C-N-CA 128.519 2.728 . . . . 0.0 107.128 177.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 22.2 tp -87.96 138.76 31.17 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 124.926 1.291 . . . . 0.0 107.618 171.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -117.23 169.04 9.78 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 123.666 0.786 . . . . 0.0 111.39 176.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.416 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 20.6 mp0 -57.94 -24.67 58.95 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.359 1.464 . . . . 0.0 112.55 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -71.57 -0.51 10.81 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.508 1.123 . . . . 0.0 113.386 178.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 66.02 12.16 8.26 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 128.395 2.678 . . . . 0.0 113.883 -178.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.416 ' CD2' ' HD1' ' A' ' 68' ' ' HIS . 1.3 p-80 -99.56 179.95 4.39 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 124.36 1.064 . . . . 0.0 110.517 168.779 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 76.6 m95 -117.47 121.55 41.33 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.49 1.516 . . . . 0.0 107.02 175.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.416 ' HD1' ' CD2' ' A' ' 66' ' ' HIS . 0.2 OUTLIER -110.78 147.71 37.03 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 125.215 1.406 . . . . 0.0 111.804 179.208 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -67.16 145.72 73.83 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.903 2.402 . . . . 0.0 112.73 -170.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -138.04 43.78 2.2 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.48 1.112 . . . . 0.0 110.852 -172.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.52 164.6 0.13 Allowed Pre-proline 0 N--CA 1.47 0.575 0 C-N-CA 128.355 2.662 . . . . 0.0 113.779 175.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -69.73 168.64 20.93 Favored 'Trans proline' 0 N--CA 1.452 -0.961 0 C-N-CA 121.343 1.362 . . . . 0.0 111.367 167.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.3 tt -123.56 143.2 40.96 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 125.105 1.362 . . . . 0.0 108.51 -172.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -79.41 163.81 24.36 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.327 2.684 . . . . 0.0 112.178 -173.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.3 -7.88 17.09 Favored 'Trans proline' 0 CA--C 1.53 0.295 0 C-N-CA 123.119 2.546 . . . . 0.0 114.741 -178.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -106.71 -16.6 14.45 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.968 1.707 . . . . 0.0 112.398 173.439 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -67.03 -29.22 74.29 Favored Glycine 0 CA--C 1.531 1.07 0 CA-C-N 119.886 1.221 . . . . 0.0 112.281 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 30.7 tp -65.32 -50.58 65.12 Favored 'General case' 0 C--N 1.34 0.16 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -60.94 -30.57 70.3 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 125.57 1.548 . . . . 0.0 110.034 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -65.99 -47.93 72.89 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 119.281 0.946 . . . . 0.0 110.106 174.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 23.2 mt -64.61 -51.13 64.25 Favored 'General case' 0 CA--C 1.52 -0.177 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 -179.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 14.8 mm -58.77 -31.85 45.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 C-N-CA 123.633 0.773 . . . . 0.0 110.899 179.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -51.88 -38.91 57.95 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 119.914 1.233 . . . . 0.0 111.702 174.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.26 -57.65 10.38 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 118.811 0.732 . . . . 0.0 111.003 176.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.463 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 21.5 t60 -55.42 -46.72 76.66 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.323 1.049 . . . . 0.0 110.038 176.662 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 73.3 m -72.7 -24.22 60.97 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 120.589 -1.319 . . . . 0.0 112.917 -174.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -97.3 -8.94 28.55 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.512 1.125 . . . . 0.0 112.902 -177.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.5 t -89.71 -20.98 22.95 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 167.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 63.8 mt -115.63 -21.61 9.61 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -176.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 101.22 19.74 15.71 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 115.679 1.031 . . . . 0.0 115.679 172.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 10.4 m-70 -79.71 -31.28 41.19 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 -158.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 18.8 m 54.73 -176.55 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.553 1.541 . . . . 0.0 113.763 -172.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . 0.404 ' HG ' ' CG ' ' A' ' 98' ' ' HIS . 3.8 m -83.19 173.29 11.79 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.273 1.029 . . . . 0.0 109.603 165.461 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -149.39 -62.59 0.22 Allowed 'General case' 0 C--O 1.235 0.334 0 C-N-CA 123.79 0.836 . . . . 0.0 109.649 173.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 10.0 m -70.93 -161.73 0.06 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 127.324 2.25 . . . . 0.0 110.634 177.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 47.1 pttt -58.24 128.29 36.38 Favored 'General case' 0 N--CA 1.464 0.244 0 O-C-N 120.695 -1.253 . . . . 0.0 108.301 170.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . 0.25 2.6 ptm 44.73 -163.48 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.972 2.109 . . . . 0.0 112.807 -175.645 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . 0.404 ' CG ' ' HG ' ' A' ' 93' ' ' CYS . 0.2 OUTLIER -61.42 -68.31 0.33 Allowed 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 168.722 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 81.1 mt -141.27 142.74 33.88 Favored 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -168.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 1.4 m170 -75.64 -36.37 60.22 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 125.038 1.461 . . . . 0.0 110.357 -174.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.6 p -164.2 -173.93 3.33 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.963 1.305 . . . . 0.0 109.977 169.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 87.7 t -60.8 -41.41 88.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 C-N-CA 124.783 1.233 . . . . 0.0 111.059 176.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.9 -46.01 78.48 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 119.677 1.126 . . . . 0.0 110.032 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -66.01 -34.26 77.69 Favored 'General case' 0 C--O 1.227 -0.098 0 C-N-CA 123.138 0.575 . . . . 0.0 110.651 178.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -55.99 -53.04 61.77 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 123.244 0.618 . . . . 0.0 110.551 175.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 30.9 mm -60.86 -34.07 57.95 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 C-N-CA 123.275 0.63 . . . . 0.0 109.805 -176.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -81.15 -27.35 35.49 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.948 0.722 . . . . 0.0 112.948 178.419 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -67.33 -65.43 0.69 Allowed 'General case' 0 C--O 1.224 -0.255 0 C-N-CA 125.299 1.44 . . . . 0.0 107.976 172.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.9 mp -49.88 -46.18 51.35 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.359 1.464 . . . . 0.0 112.019 -176.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -69.52 -19.94 63.71 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 119.171 0.896 . . . . 0.0 113.166 -179.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -93.41 -19.34 21.39 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 123.814 0.846 . . . . 0.0 111.541 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 42.1 mt -71.63 -56.49 5.74 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.404 1.082 . . . . 0.0 109.771 177.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -65.97 151.08 47.59 Favored 'General case' 0 C--O 1.24 0.556 0 CA-C-O 121.502 0.668 . . . . 0.0 111.13 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.065 0 CA-C-O 117.183 -1.898 . . . . 0.0 109.991 -171.075 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.5 ptp . . . . . 0 N--CA 1.472 0.63 0 CA-C-O 119.003 -0.522 . . . . 0.0 109.803 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 82.05 46.19 6.75 Favored Glycine 0 C--N 1.337 0.622 0 N-CA-C 110.104 -1.198 . . . . 0.0 110.104 -170.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -152.09 164.66 36.81 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 125.435 1.494 . . . . 0.0 109.532 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -125.28 -150.55 7.79 Favored Glycine 0 CA--C 1.523 0.566 0 C-N-CA 125.426 1.488 . . . . 0.0 110.512 -176.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -140.7 104.15 4.66 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 105.668 -1.975 . . . . 0.0 105.668 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 35.6 p -134.95 148.48 67.08 Favored Pre-proline 0 C--O 1.242 0.688 0 C-N-CA 125.272 1.429 . . . . 0.0 107.954 171.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -77.77 76.21 4.41 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 122.569 2.179 . . . . 0.0 110.014 -177.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 75.22 144.63 0.11 Allowed Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 128.052 2.541 . . . . 0.0 112.048 -178.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -82.79 -25.96 2.69 Favored 'Trans proline' 0 CA--C 1.538 0.682 0 C-N-CA 122.743 2.296 . . . . 0.0 112.836 174.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -74.67 -18.06 60.59 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 121.226 -0.921 . . . . 0.0 111.891 176.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.7 tt -61.84 115.22 3.84 Favored 'General case' 0 C--N 1.34 0.18 0 N-CA-C 107.175 -1.417 . . . . 0.0 107.175 167.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 23.7 mm -98.3 116.05 40.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 N-CA-C 106.71 -1.589 . . . . 0.0 106.71 174.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -62.44 154.18 73.46 Favored Pre-proline 0 C--O 1.239 0.551 0 CA-C-O 119.558 -0.258 . . . . 0.0 110.347 175.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -66.92 166.59 61.24 Favored 'Cis proline' 0 N--CA 1.458 -0.602 0 N-CA-C 114.615 0.967 . . . . 0.0 114.615 -0.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -131.87 168.09 18.45 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 123.438 0.695 . . . . 0.0 110.732 176.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 12.3 mt -138.93 94.79 2.86 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 126.084 1.754 . . . . 0.0 108.209 -175.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.2 tp -74.59 142.12 44.67 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 171.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.43 97.18 3.0 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 174.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -56.69 154.59 8.73 Favored 'General case' 0 N--CA 1.444 -0.734 0 O-C-N 124.436 1.085 . . . . 0.0 112.189 -169.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -68.53 124.77 24.5 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 114.672 -1.149 . . . . 0.0 108.61 174.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 99.02 -46.84 1.42 Allowed Glycine 0 CA--C 1.518 0.28 0 C-N-CA 125.383 1.468 . . . . 0.0 111.518 178.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 76.0 m -76.36 175.16 9.38 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 122.312 1.054 . . . . 0.0 111.231 178.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -125.88 -22.99 4.05 Favored 'General case' 0 C--N 1.334 -0.095 0 C-N-CA 125.164 1.386 . . . . 0.0 110.499 -174.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -62.95 121.2 12.96 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 124.732 1.213 . . . . 0.0 108.988 -177.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -74.16 150.68 40.3 Favored 'General case' 0 N--CA 1.454 -0.254 0 O-C-N 121.019 -1.051 . . . . 0.0 109.916 172.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -111.25 86.87 6.8 Favored Pre-proline 0 CA--C 1.532 0.279 0 C-N-CA 124.689 1.196 . . . . 0.0 108.717 173.185 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -64.39 132.88 35.16 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 121.682 1.588 . . . . 0.0 108.973 174.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.8 mt -134.56 101.28 4.9 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 -178.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.16 -38.14 87.36 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 118.559 0.618 . . . . 0.0 111.058 -169.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.0 t -151.77 180.0 7.94 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 121.964 0.887 . . . . 0.0 110.418 172.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.64 -28.79 68.83 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 125.081 1.352 . . . . 0.0 112.613 -173.414 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -59.5 -39.8 85.01 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.015 0.825 . . . . 0.0 110.439 178.255 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -60.76 -48.58 81.18 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 124.611 1.165 . . . . 0.0 109.692 177.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 25.4 t-105 -58.69 -47.96 82.74 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 123.401 0.68 . . . . 0.0 111.322 175.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -64.61 -28.34 69.56 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 123.238 0.615 . . . . 0.0 110.982 -176.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.9 mtp-105 -75.83 -38.59 57.92 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.392 0.677 . . . . 0.0 112.034 168.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 20.7 t80 -61.61 -63.05 1.4 Allowed 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.377 1.071 . . . . 0.0 109.685 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 28.8 p -71.87 -21.63 61.63 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -172.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.94 -55.43 29.58 Favored 'General case' 0 C--N 1.333 -0.126 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 172.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -74.75 3.05 8.64 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 177.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 62.0 m 60.52 -46.58 0.1 Allowed 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 128.9 2.88 . . . . 0.0 113.497 -163.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.36 -39.49 0.15 Allowed 'General case' 0 CA--C 1.519 -0.215 0 C-N-CA 130.611 3.564 . . . . 0.0 112.791 -171.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -154.89 -178.36 7.17 Favored 'General case' 0 N--CA 1.428 -1.542 0 C-N-CA 126.118 1.767 . . . . 0.0 111.564 178.264 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.54 118.93 10.18 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 126.444 1.898 . . . . 0.0 108.593 162.359 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.0 mt -92.01 120.35 32.57 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 174.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -111.56 148.49 33.13 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 124.498 1.119 . . . . 0.0 109.755 -170.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -57.96 134.84 56.71 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 161.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 89.56 3.86 74.11 Favored Glycine 0 CA--C 1.531 1.057 0 CA-C-O 118.526 -1.152 . . . . 0.0 115.256 -177.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -70.25 -2.7 14.11 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 120.206 2.003 . . . . 0.0 115.675 -170.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.4 ttmm 45.96 117.28 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 130.94 3.696 . . . . 0.0 115.685 170.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 12.9 mt -103.35 159.79 15.26 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.324 167.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 91.1 t -137.0 154.91 31.95 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 C-N-CA 127.369 2.267 . . . . 0.0 105.09 163.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -123.69 -177.25 3.68 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.966 2.106 . . . . 0.0 111.496 -178.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.71 3.03 4.43 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.796 1.639 . . . . 0.0 113.247 178.246 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -123.55 16.71 9.63 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.696 1.998 . . . . 0.0 111.111 177.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 62.74 18.89 11.03 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.904 1.282 . . . . 0.0 111.889 175.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -70.87 108.47 4.52 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 119.959 -1.713 . . . . 0.0 108.672 170.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 56.5 m -69.49 151.06 46.5 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 119.451 -0.899 . . . . 0.0 108.576 164.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -137.37 161.07 37.28 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 125.241 1.416 . . . . 0.0 108.252 169.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 25.6 t -134.78 137.67 50.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 C-N-CA 130.288 3.435 . . . . 0.0 106.018 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 16.1 tp -85.84 133.21 33.98 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 170.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -110.1 174.31 5.92 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.534 1.134 . . . . 0.0 110.843 176.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -59.9 -18.61 46.11 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.989 1.716 . . . . 0.0 112.682 176.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -76.3 -7.62 55.32 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.167 0.987 . . . . 0.0 112.033 173.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 60.3 6.76 1.09 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 128.854 2.861 . . . . 0.0 114.815 -171.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 2.1 p-80 -76.11 161.78 28.56 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 119.641 1.11 . . . . 0.0 110.261 164.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 66.1 m95 -103.72 90.77 3.75 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 125.276 1.43 . . . . 0.0 107.943 176.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -78.62 163.41 61.28 Favored Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 124.53 1.132 . . . . 0.0 110.867 179.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.64 162.13 40.43 Favored 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.337 2.025 . . . . 0.0 110.595 -176.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -150.34 45.08 0.88 Allowed 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.348 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 69.03 165.11 0.13 Allowed Pre-proline 0 C--O 1.239 0.548 0 C-N-CA 127.375 2.27 . . . . 0.0 111.193 -174.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -72.82 -175.73 2.02 Favored 'Trans proline' 0 N--CA 1.447 -1.231 0 C-N-CA 121.409 1.406 . . . . 0.0 109.726 162.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.4 tt -129.78 143.41 48.91 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 124.615 1.166 . . . . 0.0 107.935 -174.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -81.54 166.41 17.76 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.85 2.367 . . . . 0.0 110.645 -175.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -60.5 -26.36 82.63 Favored 'Trans proline' 0 CA--C 1.536 0.599 0 C-N-CA 121.153 1.236 . . . . 0.0 112.588 179.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -84.29 -18.0 37.79 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 124.892 1.277 . . . . 0.0 113.078 176.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.45 -25.02 75.29 Favored Glycine 0 C--N 1.341 0.83 0 N-CA-C 111.225 -0.75 . . . . 0.0 111.225 -173.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 26.8 tp -65.02 -49.63 69.43 Favored 'General case' 0 C--N 1.339 0.131 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 177.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . 0.42 HD21 ' CG ' ' A' ' 98' ' ' HIS . 2.8 m120 -56.58 -39.34 73.34 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.066 0.947 . . . . 0.0 109.304 173.157 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -65.9 -34.32 77.85 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.696 0.798 . . . . 0.0 112.146 178.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.7 mp -62.17 -64.0 1.07 Allowed 'General case' 0 C--N 1.34 0.173 0 O-C-N 121.076 -1.015 . . . . 0.0 109.044 168.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 32.9 mm -60.37 -26.96 38.68 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 123.167 0.587 . . . . 0.0 110.987 -170.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.74 -41.08 6.55 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 125.921 1.688 . . . . 0.0 111.714 169.685 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.45 -57.79 7.43 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 118.949 0.795 . . . . 0.0 110.765 -176.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 13.8 t60 -54.62 -48.01 72.73 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.659 1.184 . . . . 0.0 110.112 174.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 58.3 m -65.29 -37.01 85.83 Favored 'General case' 0 C--O 1.225 -0.199 0 O-C-N 120.849 -1.157 . . . . 0.0 111.231 -177.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -77.95 -16.91 57.78 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 119.154 0.888 . . . . 0.0 112.525 -178.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . 0.257 2.0 t -89.53 -30.27 18.34 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 119.51 1.05 . . . . 0.0 110.035 174.478 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 80.0 mt -96.07 -9.69 30.25 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 119.403 1.001 . . . . 0.0 112.966 178.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 73.16 28.82 65.57 Favored Glycine 0 CA--C 1.527 0.843 0 C-N-CA 125.453 1.501 . . . . 0.0 113.822 -178.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 27.4 m-70 -80.05 169.93 17.15 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 118.497 1.149 . . . . 0.0 111.871 -176.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 70.9 m -111.63 162.27 15.36 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.643 1.577 . . . . 0.0 110.563 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 16.4 p -83.05 6.2 19.73 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 114.417 1.266 . . . . 0.0 114.417 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 23.4 p 60.21 -164.78 0.22 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.091 0.957 . . . . 0.0 110.475 175.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 35.0 m -86.7 -173.04 4.29 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 164.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 64.13 27.26 14.05 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 119.386 0.994 . . . . 0.0 112.674 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 8.3 tmm? 44.84 71.69 0.25 Allowed 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.617 1.567 . . . . 0.0 110.573 177.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . 0.42 ' CG ' HD21 ' A' ' 79' ' ' ASN . 66.6 m80 58.98 -85.48 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.52 1.128 . . . . 0.0 111.189 -166.042 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 97.8 mt -148.93 134.6 18.75 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.133 0.973 . . . . 0.0 108.883 -152.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 41.4 t-80 -69.39 -39.2 78.13 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 120.869 0.366 . . . . 0.0 111.253 178.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 5.2 t -164.29 -174.14 3.39 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.194 1.398 . . . . 0.0 108.895 176.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 88.9 t -61.05 -37.68 77.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 C-N-CA 125.622 1.569 . . . . 0.0 111.585 -176.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 11.4 ttm -57.56 -48.19 80.0 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 118.933 0.788 . . . . 0.0 110.286 177.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -54.34 -41.35 68.99 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 125.704 1.602 . . . . 0.0 110.254 -177.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.47 -47.9 72.41 Favored 'General case' 0 C--O 1.227 -0.113 0 C-N-CA 125.026 1.33 . . . . 0.0 111.766 177.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 38.5 mm -61.73 -43.72 97.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 -176.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -68.08 -34.49 76.5 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 118.671 -0.681 . . . . 0.0 111.398 178.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 33.0 t80 -60.47 -65.57 0.67 Allowed 'General case' 0 C--O 1.226 -0.133 0 C-N-CA 123.889 0.876 . . . . 0.0 109.433 174.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.0 mp -48.16 -49.91 30.77 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 125.246 1.418 . . . . 0.0 111.766 178.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 16.7 m-80 -65.54 -31.7 72.89 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 118.781 -0.628 . . . . 0.0 112.358 -178.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -75.86 -27.46 57.8 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 117.985 -1.007 . . . . 0.0 111.292 176.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 59.8 mt -63.4 -64.68 0.84 Allowed 'General case' 0 N--CA 1.457 -0.111 0 CA-C-N 119.406 1.003 . . . . 0.0 108.789 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 44.56 50.78 8.22 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 126.144 1.777 . . . . 0.0 111.445 -169.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.677 0 N-CA-C 108.774 -1.731 . . . . 0.0 108.774 167.917 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.4 ttm . . . . . 0 N--CA 1.469 0.486 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -64.68 162.11 38.53 Favored Glycine 0 C--N 1.339 0.745 0 CA-C-N 119.681 1.128 . . . . 0.0 110.874 172.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -145.92 106.99 4.15 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 124.489 1.116 . . . . 0.0 108.004 179.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 75.66 160.02 8.67 Favored Glycine 0 C--N 1.33 0.242 0 N-CA-C 110.019 -1.232 . . . . 0.0 110.019 -161.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 60.97 9.44 2.31 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 115.246 1.572 . . . . 0.0 115.246 170.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 29.3 p -70.16 144.81 92.96 Favored Pre-proline 0 C--N 1.324 -0.505 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 157.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -73.49 94.63 0.85 Allowed 'Trans proline' 0 N--CA 1.444 -1.432 0 C-N-CA 121.837 1.691 . . . . 0.0 108.728 174.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 75.17 147.27 0.12 Allowed Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 128.35 2.66 . . . . 0.0 111.873 -174.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -79.39 -32.35 1.73 Allowed 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 123.264 2.643 . . . . 0.0 112.379 170.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -83.87 -6.6 59.46 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.851 1.26 . . . . 0.0 112.764 -176.04 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.44 132.29 49.6 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.838 1.255 . . . . 0.0 108.105 164.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.8 mm -115.33 115.83 50.61 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.131 0 C-N-CA 124.823 1.249 . . . . 0.0 107.966 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 71.2 m95 -60.6 151.33 71.44 Favored Pre-proline 0 C--O 1.235 0.296 0 C-N-CA 123.494 0.718 . . . . 0.0 111.725 177.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -72.32 174.15 49.54 Favored 'Cis proline' 0 CA--C 1.537 0.65 0 N-CA-C 115.266 1.218 . . . . 0.0 115.266 0.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -128.81 166.77 18.39 Favored 'General case' 0 C--N 1.344 0.339 0 C-N-CA 123.39 0.676 . . . . 0.0 112.817 -179.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 18.1 mt -139.49 99.63 3.78 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 127.795 2.438 . . . . 0.0 107.937 178.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 23.8 tp -70.44 152.95 43.49 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 117.883 -1.056 . . . . 0.0 108.444 169.41 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -144.87 85.95 1.77 Allowed 'General case' 0 C--O 1.234 0.267 0 CA-C-N 120.238 1.381 . . . . 0.0 111.588 170.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -44.45 127.28 5.82 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 125.728 1.611 . . . . 0.0 110.517 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.4 tp60 -68.49 90.77 0.39 Allowed 'General case' 0 N--CA 1.432 -1.366 0 C-N-CA 126.036 1.735 . . . . 0.0 111.142 -170.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 115.06 -17.55 17.12 Favored Glycine 0 CA--C 1.524 0.627 0 CA-C-O 118.267 -1.296 . . . . 0.0 112.173 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.463 ' C ' ' H ' ' A' ' 24' ' ' GLU . 3.8 t -71.38 -33.35 69.45 Favored 'General case' 0 C--O 1.22 -0.454 0 CA-C-N 118.881 1.341 . . . . 0.0 109.957 173.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 68.7 -20.83 0.15 Allowed 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.908 1.683 . . . . 0.0 112.552 -172.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.463 ' H ' ' C ' ' A' ' 22' ' ' CYS . 23.3 tt0 -64.86 138.26 58.27 Favored 'General case' 0 N--CA 1.441 -0.918 0 C-N-CA 125.308 1.443 . . . . 0.0 108.352 172.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.432 ' CD1' ' HA ' ' A' ' 82' ' ' ILE . 1.3 mt -96.98 150.6 20.58 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 124.164 0.986 . . . . 0.0 108.519 169.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -113.73 87.83 12.85 Favored Pre-proline 0 C--N 1.327 -0.403 0 C-N-CA 124.768 1.227 . . . . 0.0 110.226 175.104 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -64.23 137.43 56.33 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 123.083 2.522 . . . . 0.0 109.994 176.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.7 mt -141.47 117.12 10.32 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 106.783 -1.562 . . . . 0.0 106.783 -177.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -69.0 -53.59 19.74 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.235 0.541 . . . . 0.0 112.03 -173.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 64.3 p -138.85 165.11 27.89 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.983 0.913 . . . . 0.0 108.612 -175.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -50.59 -30.85 14.25 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 123.384 0.674 . . . . 0.0 112.652 -177.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.9 -42.54 76.15 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.257 1.023 . . . . 0.0 111.595 174.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.44 -47.32 79.53 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 121.216 -0.927 . . . . 0.0 110.484 179.038 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 41.0 t-105 -58.06 -47.04 84.35 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 176.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 -55.09 -58.41 7.76 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.474 0.709 . . . . 0.0 109.444 178.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -64.64 -14.66 59.07 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 125.336 1.455 . . . . 0.0 113.587 -178.166 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.47 ' CZ ' ' CD2' ' A' ' 43' ' ' HIS . 44.8 t80 -79.1 -63.39 1.43 Allowed 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 173.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 8.7 t -66.48 -29.32 69.41 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.295 -0.878 . . . . 0.0 111.586 -176.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.78 -13.82 62.47 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 124.531 1.132 . . . . 0.0 112.091 -178.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -109.93 6.16 22.98 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 119.322 0.965 . . . . 0.0 111.737 -174.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 48.84 40.32 16.16 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.865 1.666 . . . . 0.0 111.936 -170.46 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -51.45 -42.12 61.34 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 123.499 0.72 . . . . 0.0 111.241 178.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.47 ' CD2' ' CZ ' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -151.1 -167.17 2.74 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.45 1.5 . . . . 0.0 107.622 -173.488 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.7 mp -123.51 125.34 44.72 Favored 'General case' 0 CA--C 1.513 -0.475 0 C-N-CA 124.807 1.243 . . . . 0.0 109.734 -178.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 85.1 mt -82.67 134.99 35.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.308 0.575 . . . . 0.0 109.637 171.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -149.85 162.33 40.51 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.616 1.166 . . . . 0.0 109.051 -173.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -71.39 105.01 3.37 Favored 'General case' 0 C--O 1.237 0.443 0 O-C-N 121.612 -0.68 . . . . 0.0 109.217 -163.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 122.47 5.31 8.61 Favored Glycine 0 CA--C 1.526 0.748 0 CA-C-O 117.433 -1.759 . . . . 0.0 114.787 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.95 -15.58 1.45 Allowed 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 117.255 2.317 . . . . 0.0 117.255 -175.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.5 ttmt 44.63 125.67 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.221 1 C-N-CA 132.171 4.188 . . . . 0.0 115.295 -177.005 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.7 mt -109.99 139.42 45.11 Favored 'General case' 0 CA--C 1.512 -0.51 0 O-C-N 120.942 -1.099 . . . . 0.0 108.089 166.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 55.2 t -113.01 151.29 14.92 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 N-CA-C 105.098 -2.186 . . . . 0.0 105.098 162.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -131.22 172.19 12.42 Favored 'General case' 0 N--CA 1.437 -1.118 0 C-N-CA 130.294 3.438 . . . . 0.0 108.617 -177.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.7 t -56.71 -20.69 23.11 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.36 1.464 . . . . 0.0 113.048 177.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -98.35 -0.09 44.43 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.096 1.758 . . . . 0.0 112.619 -169.641 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 59.63 15.3 4.55 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.989 1.716 . . . . 0.0 112.54 -171.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 48.1 m170 -70.18 106.4 3.28 Favored 'General case' 0 CA--C 1.529 0.15 0 O-C-N 120.076 -1.64 . . . . 0.0 109.638 164.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 2.9 t -71.86 151.57 43.3 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 174.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -139.1 153.77 48.06 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 124.55 1.14 . . . . 0.0 108.757 176.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 27.8 t -141.91 135.41 29.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 C-N-CA 127.526 2.33 . . . . 0.0 107.336 -176.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 29.5 tp -80.7 133.44 35.69 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 126.051 1.74 . . . . 0.0 107.719 176.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -125.83 170.35 11.71 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.14 0.976 . . . . 0.0 109.441 178.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -66.57 -29.3 69.34 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.12 0.968 . . . . 0.0 112.001 -167.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -66.73 8.8 0.22 Allowed 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.795 1.238 . . . . 0.0 112.954 171.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 63.48 28.25 15.31 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 126.434 1.894 . . . . 0.0 111.674 168.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.4 p-80 -114.75 166.52 11.66 Favored 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 124.948 1.299 . . . . 0.0 110.191 170.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 65.3 m95 -103.71 98.09 8.01 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 126.638 1.975 . . . . 0.0 106.785 174.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 63.3 t-80 -71.08 143.52 88.79 Favored Pre-proline 0 CA--C 1.539 0.55 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 178.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -72.08 113.39 3.67 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 123.806 3.004 . . . . 0.0 109.669 172.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -91.89 34.54 1.0 Allowed 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.95 1.7 . . . . 0.0 111.99 -173.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 64.89 166.27 0.12 Allowed Pre-proline 0 CA--C 1.547 0.849 0 C-N-CA 126.684 1.994 . . . . 0.0 111.759 -175.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -67.03 -177.8 1.13 Allowed 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 121.931 1.754 . . . . 0.0 112.626 178.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.2 tt -132.61 143.88 50.62 Favored Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 126.053 1.741 . . . . 0.0 108.745 -175.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -80.83 164.4 20.41 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 123.005 2.47 . . . . 0.0 111.968 -176.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -61.44 -10.87 17.41 Favored 'Trans proline' 0 CA--C 1.528 0.224 0 C-N-CA 123.013 2.475 . . . . 0.0 115.441 178.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -106.34 -15.59 14.79 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.043 1.737 . . . . 0.0 113.505 175.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.59 -37.99 95.59 Favored Glycine 0 CA--C 1.529 0.93 0 CA-C-N 119.051 0.841 . . . . 0.0 111.301 -177.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.3 tp -52.74 -47.74 67.18 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 125.291 1.436 . . . . 0.0 108.384 177.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -75.64 -17.34 60.02 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 127.625 2.37 . . . . 0.0 110.527 -170.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -84.31 -42.39 15.86 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.043 1.337 . . . . 0.0 110.502 170.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.5 mp -58.99 -52.74 64.46 Favored 'General case' 0 N--CA 1.46 0.073 0 C-N-CA 123.196 0.598 . . . . 0.0 109.895 176.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.432 ' HA ' ' CD1' ' A' ' 25' ' ' LEU . 4.1 mm -62.1 -33.51 58.84 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.148 0 C-N-CA 123.675 0.79 . . . . 0.0 110.653 178.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.86 -42.36 58.8 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 121.455 -0.778 . . . . 0.0 110.923 171.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.75 -42.64 90.68 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 118.997 -0.525 . . . . 0.0 112.3 -177.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 7.8 t60 -60.14 -53.44 57.77 Favored 'General case' 0 C--O 1.222 -0.346 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 172.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 94.8 m -57.03 -42.24 80.07 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 121.361 -0.837 . . . . 0.0 110.201 -174.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.42 -22.26 66.78 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-O 116.832 -1.556 . . . . 0.0 114.239 -178.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . 0.377 11.8 t -93.57 -13.39 27.77 Favored 'General case' 0 C--N 1.345 0.403 0 CA-C-N 121.3 1.863 . . . . 0.0 110.925 -177.06 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -107.85 -14.61 14.74 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 126.322 1.849 . . . . 0.0 111.625 -179.248 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 77.87 15.21 81.49 Favored Glycine 0 CA--C 1.53 0.988 0 CA-C-O 118.416 -1.214 . . . . 0.0 113.27 -172.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 69.2 m-70 -75.76 160.56 29.88 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 119.163 1.482 . . . . 0.0 109.57 -178.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 59.7 m -109.26 163.38 13.42 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 123.515 0.726 . . . . 0.0 109.855 177.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 34.7 m -55.88 164.27 1.22 Allowed 'General case' 0 C--O 1.237 0.442 0 C-N-CA 124.313 1.045 . . . . 0.0 110.138 160.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 66.2 p -119.88 -163.02 0.96 Allowed 'General case' 0 C--O 1.239 0.53 0 C-N-CA 126.847 2.059 . . . . 0.0 106.902 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.38 169.6 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.19 0.996 . . . . 0.0 111.903 171.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . 0.285 0.0 OUTLIER 53.29 -170.71 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.4 1.48 . . . . 0.0 112.503 -176.938 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.09 77.3 4.6 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 178.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 4.6 t-160 67.01 -75.17 0.06 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.502 1.521 . . . . 0.0 109.749 -177.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 93.3 mt -141.63 153.56 44.83 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 121.851 2.114 . . . . 0.0 110.639 174.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 23.9 t-80 -75.37 -39.25 59.45 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.716 175.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -175.05 178.28 1.79 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 122.948 0.499 . . . . 0.0 111.464 -167.601 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 58.4 t -64.45 -39.47 85.68 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 123.653 0.781 . . . . 0.0 109.892 -176.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 3.5 tpt -56.92 -32.1 65.6 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.795 -0.566 . . . . 0.0 111.796 177.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -72.2 -48.74 40.8 Favored 'General case' 0 C--O 1.226 -0.176 0 C-N-CA 124.429 1.091 . . . . 0.0 108.221 176.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.06 -50.08 67.54 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 125.224 1.41 . . . . 0.0 112.542 -178.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 37.6 mm -57.17 -45.81 84.58 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -178.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -74.03 -24.73 59.59 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.279 1.032 . . . . 0.0 112.733 -175.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -67.26 -70.46 0.25 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.993 0.917 . . . . 0.0 109.088 168.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 9.4 mp -51.39 -51.19 56.81 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 127.02 2.128 . . . . 0.0 113.298 -177.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -64.23 -12.6 42.39 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 118.186 -0.911 . . . . 0.0 112.28 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -100.85 -7.25 23.74 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 120.105 1.32 . . . . 0.0 112.303 175.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 95.8 mt -90.37 -47.71 7.57 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.79 1.236 . . . . 0.0 110.194 173.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -74.18 149.72 40.78 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 122.899 0.48 . . . . 0.0 110.626 -173.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.284 0 N-CA-C 106.913 -2.475 . . . . 0.0 106.913 -169.162 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.657 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 125.11 133.94 4.07 Favored Glycine 0 C--N 1.334 0.447 0 C-N-CA 126.089 1.804 . . . . 0.0 109.341 176.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -98.13 -160.21 0.79 Allowed 'General case' 0 C--O 1.238 0.478 0 C-N-CA 124.862 1.265 . . . . 0.0 110.351 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 141.52 -66.68 0.49 Allowed Glycine 0 C--N 1.338 0.645 0 O-C-N 121.402 -0.811 . . . . 0.0 114.2 171.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.0 mp0 -129.45 10.77 5.74 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.034 1.334 . . . . 0.0 112.501 -164.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -144.43 161.45 44.19 Favored Pre-proline 0 C--N 1.325 -0.475 0 C-N-CA 126.903 2.081 . . . . 0.0 109.159 -173.099 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -69.16 -55.33 0.2 Allowed 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 121.009 1.139 . . . . 0.0 110.555 -167.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 5.4 t-80 -144.5 148.36 40.0 Favored Pre-proline 0 N--CA 1.451 -0.407 0 C-N-CA 126.614 1.965 . . . . 0.0 106.409 172.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -72.96 -28.98 12.53 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 CA-C-N 120.919 1.364 . . . . 0.0 112.658 179.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -80.63 -10.02 59.76 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 118.726 -0.654 . . . . 0.0 112.06 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.5 tt -58.76 132.65 54.54 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 119.084 0.856 . . . . 0.0 109.851 168.411 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.417 ' CG1' HD22 ' A' ' 55' ' ' ASN . 45.6 mm -113.77 113.01 42.67 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 175.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 76.6 m95 -57.8 150.11 49.9 Favored Pre-proline 0 C--O 1.241 0.637 0 C-N-CA 123.255 0.622 . . . . 0.0 111.346 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -71.72 173.22 52.2 Favored 'Cis proline' 0 CA--C 1.54 0.785 0 N-CA-C 114.768 1.026 . . . . 0.0 114.768 0.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -131.17 167.47 19.1 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 124.29 1.036 . . . . 0.0 111.818 176.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 27.1 mt -139.54 105.09 5.09 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 126.851 2.061 . . . . 0.0 110.031 -175.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.54 ' CD1' ' H ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -81.56 165.01 21.52 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 123.602 0.761 . . . . 0.0 109.592 168.534 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.54 ' H ' ' CD1' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -156.64 88.04 1.04 Allowed 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 119.445 -0.312 . . . . 0.0 110.445 163.248 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 22.5 mt-30 -51.6 135.6 28.12 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -166.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -68.26 116.73 9.19 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 -176.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 105.3 -2.79 40.19 Favored Glycine 0 CA--C 1.525 0.704 0 CA-C-O 117.398 -1.779 . . . . 0.0 113.615 -173.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.83 172.75 7.94 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 119.956 1.878 . . . . 0.0 109.929 165.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -110.95 -17.62 13.26 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 125.501 1.52 . . . . 0.0 108.881 177.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -76.24 127.98 34.0 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 -177.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.405 ' CD1' ' HA ' ' A' ' 82' ' ' ILE . 1.3 mt -82.53 159.51 22.81 Favored 'General case' 0 C--O 1.231 0.1 0 C-N-CA 123.48 0.712 . . . . 0.0 109.539 170.445 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -122.6 88.95 49.79 Favored Pre-proline 0 C--N 1.328 -0.33 0 C-N-CA 125.665 1.586 . . . . 0.0 110.71 -173.475 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -62.09 126.3 18.39 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 123.777 2.985 . . . . 0.0 109.961 179.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -115.28 100.37 8.08 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 107.154 -1.425 . . . . 0.0 107.154 169.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 67.5 mtt-85 -52.64 -53.16 50.81 Favored 'General case' 0 N--CA 1.463 0.196 0 C-N-CA 124.584 1.154 . . . . 0.0 110.59 175.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.0 t -144.23 -177.75 5.62 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 122.313 1.054 . . . . 0.0 109.828 178.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -50.92 -39.1 53.78 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 126.571 1.948 . . . . 0.0 110.841 178.142 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -43.03 98.23 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.393 0.677 . . . . 0.0 111.222 178.185 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -68.2 -26.82 65.92 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 124.33 1.052 . . . . 0.0 110.773 -177.467 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 60.8 t-105 -79.25 -41.18 28.79 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 123.663 0.785 . . . . 0.0 111.81 170.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -58.04 -45.66 86.63 Favored 'General case' 0 N--CA 1.462 0.132 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 178.167 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -46.17 -46.43 17.37 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 125.209 1.404 . . . . 0.0 112.363 173.371 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 11.4 t80 -55.64 -54.62 41.99 Favored 'General case' 0 N--CA 1.453 -0.322 0 O-C-N 123.574 0.546 . . . . 0.0 110.293 -174.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 43.9 t -75.63 -27.85 58.58 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.278 1.031 . . . . 0.0 111.136 -179.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.72 -24.92 67.97 Favored 'General case' 0 N--CA 1.457 -0.12 0 C-N-CA 123.809 0.844 . . . . 0.0 110.422 175.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -82.21 68.15 8.5 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 122.902 1.334 . . . . 0.0 110.557 -178.539 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 17.4 t 54.83 32.11 17.0 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 125.812 1.645 . . . . 0.0 114.407 178.253 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 40.5 mtmt 44.63 58.19 4.04 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 123.865 0.866 . . . . 0.0 108.812 -168.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -44.46 152.32 0.21 Allowed 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 157.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -44.63 121.98 2.92 Favored 'General case' 0 N--CA 1.439 -1.009 0 C-N-CA 127.161 2.185 . . . . 0.0 113.01 -163.471 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 49.0 mt -138.43 111.41 7.81 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 105.157 -2.164 . . . . 0.0 105.157 169.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -121.1 164.44 16.82 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 123.584 0.754 . . . . 0.0 109.81 -178.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.407 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 13.3 m-85 -60.34 138.64 57.93 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 176.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 84.2 9.12 82.67 Favored Glycine 0 CA--C 1.524 0.614 0 CA-C-O 119.106 -0.83 . . . . 0.0 113.496 174.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -65.46 -25.88 67.7 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 119.41 1.605 . . . . 0.0 112.485 -171.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 19.9 ttmt 75.12 145.5 0.08 Allowed 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 129.523 3.129 . . . . 0.0 112.421 175.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 9.4 tp -135.57 157.86 45.82 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 107.521 -1.288 . . . . 0.0 107.521 171.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 24.2 t -134.45 141.89 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.74 0 C-N-CA 127.456 2.302 . . . . 0.0 106.27 167.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -104.11 176.65 5.08 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.897 1.279 . . . . 0.0 112.067 167.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -69.54 -5.41 24.08 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 -179.581 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.417 HD22 ' CG1' ' A' ' 12' ' ' ILE . 70.3 m-80 -89.87 -1.27 57.95 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 119.412 1.005 . . . . 0.0 111.252 170.016 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 70.13 18.97 6.88 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 127.08 2.152 . . . . 0.0 110.959 -171.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 23.4 m170 -66.88 117.24 8.71 Favored 'General case' 0 C--N 1.34 0.164 0 O-C-N 120.801 -1.187 . . . . 0.0 108.891 169.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 72.6 m -83.11 156.32 23.35 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 118.997 0.817 . . . . 0.0 110.11 169.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -144.71 158.45 43.78 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 125.968 1.707 . . . . 0.0 109.313 177.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 24.4 t -115.86 162.73 13.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 C-N-CA 127.885 2.474 . . . . 0.0 106.907 169.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 29.2 tp -111.82 133.45 54.02 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 166.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 62.1 mp0 -113.58 -172.8 2.14 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.742 2.017 . . . . 0.0 109.807 -171.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.407 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 2.5 mp0 -77.06 -18.31 58.15 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 120.734 -1.229 . . . . 0.0 113.3 178.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -75.25 -7.98 55.36 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 127.502 2.321 . . . . 0.0 113.444 -168.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 64.34 17.1 10.57 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 129.158 2.983 . . . . 0.0 114.376 -161.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.1 p-80 -93.94 162.4 13.91 Favored 'General case' 0 C--N 1.34 0.195 0 C-N-CA 125.881 1.672 . . . . 0.0 114.336 164.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 62.0 m95 -106.58 106.41 16.92 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 106.644 -1.613 . . . . 0.0 106.644 164.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -87.13 156.37 54.62 Favored Pre-proline 0 CA--C 1.545 0.773 0 C-N-CA 123.484 0.713 . . . . 0.0 109.104 175.083 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -79.78 156.21 24.03 Favored 'Trans proline' 0 N--CA 1.455 -0.759 0 C-N-CA 122.303 2.002 . . . . 0.0 111.989 -172.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -132.25 31.91 4.04 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.056 1.342 . . . . 0.0 110.991 -177.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 71.72 165.42 0.13 Allowed Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 128.115 2.566 . . . . 0.0 111.802 179.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -71.43 -179.18 3.43 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 121.677 1.585 . . . . 0.0 109.927 169.226 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 12.8 tp -133.68 150.89 76.02 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-O 118.56 -0.733 . . . . 0.0 111.699 -174.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -61.97 159.47 33.81 Favored 'Trans proline' 0 CA--C 1.536 0.589 0 C-N-CA 122.178 1.919 . . . . 0.0 111.173 166.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -67.88 -38.06 14.17 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 122.329 2.019 . . . . 0.0 111.245 -178.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -72.86 -11.02 60.43 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 124.162 0.985 . . . . 0.0 110.569 175.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -68.78 -28.5 73.05 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-O 118.934 -0.926 . . . . 0.0 111.416 171.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 46.5 tp -62.88 -54.15 43.18 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 118.523 1.161 . . . . 0.0 108.728 170.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -50.24 -43.92 53.17 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.588 1.155 . . . . 0.0 111.661 177.36 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -60.78 -36.82 79.94 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 126.099 1.76 . . . . 0.0 112.724 177.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -72.22 -54.4 9.72 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 119.181 0.9 . . . . 0.0 109.84 172.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.405 ' HA ' ' CD1' ' A' ' 25' ' ' LEU . 4.4 mm -50.01 -37.82 13.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 126.372 1.869 . . . . 0.0 110.553 -177.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.01 -40.62 6.66 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 125.687 1.595 . . . . 0.0 112.661 176.3 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.34 -58.36 8.86 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 119.573 1.078 . . . . 0.0 111.581 178.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -58.82 -45.48 89.88 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 124.166 0.986 . . . . 0.0 109.383 -179.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 96.0 m -73.32 -17.18 61.33 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 120.641 -1.287 . . . . 0.0 112.774 -176.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -84.47 -20.62 31.42 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 119.396 0.998 . . . . 0.0 112.17 173.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.4 t -100.87 -17.35 16.89 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.37 0.532 . . . . 0.0 111.009 -178.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 52.2 mt -102.18 2.83 37.74 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.973 1.309 . . . . 0.0 111.166 165.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 66.59 15.4 64.0 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 125.187 1.375 . . . . 0.0 115.692 171.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 37.4 m-70 -80.08 -35.13 37.39 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 119.5 1.65 . . . . 0.0 112.648 -174.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 68.0 m 47.54 -172.4 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 124.859 1.264 . . . . 0.0 113.479 -166.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 7.4 p -97.62 160.41 14.33 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 124.641 1.176 . . . . 0.0 111.4 -177.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 4.3 t 174.97 161.54 0.22 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 129.203 3.001 . . . . 0.0 105.703 -179.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 63.92 109.96 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.382 1.873 . . . . 0.0 112.454 171.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.6 ttpm? 55.41 52.78 10.78 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.352 1.061 . . . . 0.0 111.03 171.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 8.6 ttp 48.37 43.6 19.53 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.474 1.91 . . . . 0.0 112.564 -174.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 74.91 -58.53 0.57 Allowed 'General case' 0 C--N 1.34 0.195 0 C-N-CA 125.752 1.621 . . . . 0.0 111.176 -170.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 91.4 mt -155.08 121.87 5.42 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 126.259 1.824 . . . . 0.0 107.351 -155.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 32.1 t-80 -67.88 -37.1 81.36 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 117.889 0.313 . . . . 0.0 111.371 171.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 4.7 t -158.92 176.12 12.71 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.781 0.832 . . . . 0.0 111.477 -171.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 79.0 t -55.77 -36.9 44.85 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 C-N-CA 124.19 0.996 . . . . 0.0 108.988 167.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 26.0 tpp -60.01 -39.6 86.37 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.611 0.764 . . . . 0.0 112.311 178.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -61.28 -52.77 63.35 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 176.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.77 -41.7 70.82 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 125.005 1.322 . . . . 0.0 112.338 -171.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 22.4 mm -56.73 -46.89 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.266 0 CA-C-N 120.03 1.286 . . . . 0.0 111.127 -177.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -79.83 -36.89 36.18 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 118.164 0.438 . . . . 0.0 110.194 -178.27 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -59.77 -51.6 69.06 Favored 'General case' 0 C--N 1.337 0.056 0 C-N-CA 125.09 1.356 . . . . 0.0 110.978 -178.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 95.8 mt -68.06 -31.27 70.79 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 125.083 1.353 . . . . 0.0 110.902 -177.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -65.99 -40.15 90.93 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-O 118.894 -0.574 . . . . 0.0 110.8 175.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -75.07 0.68 15.25 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.583 1.153 . . . . 0.0 113.071 -179.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 45.4 mt -80.39 -28.09 38.0 Favored 'General case' 0 N--CA 1.457 -0.109 0 CA-C-N 118.95 0.795 . . . . 0.0 110.488 166.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -81.6 164.91 21.55 Favored 'General case' 0 C--O 1.24 0.563 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 166.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.163 0 N-CA-C 106.8 -2.52 . . . . 0.0 106.8 -164.05 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.4 mtp . . . . . 0 N--CA 1.477 0.908 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 128.51 -57.77 0.71 Allowed Glycine 0 CA--C 1.522 0.495 0 N-CA-C 109.243 -1.543 . . . . 0.0 109.243 -176.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 48.53 -154.64 0.09 Allowed 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.199 1.4 . . . . 0.0 111.709 -176.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 91.47 -117.46 5.21 Favored Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 106.81 -2.516 . . . . 0.0 106.81 -162.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -96.64 10.87 37.29 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.771 1.628 . . . . 0.0 112.895 -161.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.7 p -83.99 160.1 58.61 Favored Pre-proline 0 CA--C 1.537 0.479 0 C-N-CA 125.145 1.378 . . . . 0.0 110.546 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -67.88 -55.0 0.29 Allowed 'Trans proline' 0 N--CA 1.459 -0.5 0 C-N-CA 122.467 2.111 . . . . 0.0 111.267 -169.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -135.75 144.29 48.23 Favored Pre-proline 0 C--O 1.238 0.482 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 176.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -77.4 -17.75 14.43 Favored 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 122.394 2.063 . . . . 0.0 111.965 -176.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -81.43 -26.43 35.36 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 117.636 -1.174 . . . . 0.0 111.964 173.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 tt -56.68 133.34 53.85 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.295 0.952 . . . . 0.0 109.823 -171.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.415 ' CG1' HD22 ' A' ' 55' ' ' ASN . 46.7 mm -112.71 116.37 52.4 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.123 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 -175.051 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 76.5 m95 -60.52 154.35 55.71 Favored Pre-proline 0 N--CA 1.45 -0.444 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.64 176.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -72.15 162.94 88.84 Favored 'Cis proline' 0 N--CA 1.458 -0.597 0 C-N-CA 124.853 -0.895 . . . . 0.0 112.684 -3.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -131.96 166.53 21.48 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 121.773 0.797 . . . . 0.0 110.966 179.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 38.6 mt -138.26 106.5 5.77 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 124.917 1.287 . . . . 0.0 108.813 -170.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.2 tp -84.67 148.79 26.23 Favored 'General case' 0 C--O 1.236 0.395 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 171.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -142.54 96.67 2.98 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 119.612 1.097 . . . . 0.0 108.592 167.135 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -55.15 151.57 9.14 Favored 'General case' 0 C--O 1.24 0.575 0 O-C-N 124.628 1.205 . . . . 0.0 112.425 -164.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -71.02 88.56 0.77 Allowed 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.512 0.672 . . . . 0.0 110.967 -177.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 137.15 -34.3 2.21 Favored Glycine 0 CA--C 1.524 0.633 0 C-N-CA 126.251 1.881 . . . . 0.0 110.618 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 85.3 m -76.86 177.07 7.96 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 122.89 1.329 . . . . 0.0 111.257 -178.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -128.82 -35.25 1.89 Allowed 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 126.712 2.005 . . . . 0.0 109.216 -175.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -59.69 131.71 51.76 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.231 1.412 . . . . 0.0 107.856 169.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -84.17 150.73 25.31 Favored 'General case' 0 CA--C 1.515 -0.393 0 C-N-CA 124.351 1.061 . . . . 0.0 108.678 164.232 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -103.68 88.64 1.89 Allowed Pre-proline 0 C--N 1.327 -0.403 0 C-N-CA 128.294 2.637 . . . . 0.0 107.549 176.277 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -56.89 127.13 24.59 Favored 'Trans proline' 0 N--CA 1.45 -1.037 0 N-CA-C 108.988 -1.197 . . . . 0.0 108.988 169.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -118.22 103.54 9.94 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 106.089 -1.819 . . . . 0.0 106.089 166.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 67.8 mtt85 -56.74 -42.51 79.41 Favored 'General case' 0 CA--C 1.519 -0.213 0 O-C-N 122.279 -0.263 . . . . 0.0 110.562 174.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.0 t -157.49 -177.47 6.62 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 118.344 0.52 . . . . 0.0 110.782 -177.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -51.95 -42.37 62.8 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 125.411 1.485 . . . . 0.0 110.695 174.256 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -54.44 -50.77 66.87 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-N 118.713 0.688 . . . . 0.0 110.639 175.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -57.2 -45.6 83.64 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.217 1.407 . . . . 0.0 110.368 178.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 39.6 t-105 -58.3 -40.93 83.31 Favored 'General case' 0 C--N 1.34 0.18 0 C-N-CA 123.8 0.84 . . . . 0.0 111.274 176.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.91 -45.25 90.76 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 178.472 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 8.4 mtt180 -62.6 -32.08 73.02 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 124.056 0.943 . . . . 0.0 111.531 -168.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -49.63 -61.19 2.25 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 125.052 1.341 . . . . 0.0 109.745 171.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 34.6 t -69.23 -35.84 76.59 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -175.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.6 -24.07 67.65 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.782 0.833 . . . . 0.0 110.938 -177.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -78.48 6.01 9.48 Favored 'General case' 0 C--N 1.342 0.267 0 N-CA-C 113.507 0.929 . . . . 0.0 113.507 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 71.13 8.12 6.35 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.823 1.249 . . . . 0.0 111.355 -170.644 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 49.8 mmtt -94.73 38.24 1.12 Allowed 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 125.623 1.569 . . . . 0.0 110.35 -177.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -74.99 32.03 0.1 Allowed 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 114.31 1.226 . . . . 0.0 114.31 -175.408 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.61 103.54 1.1 Allowed 'General case' 0 N--CA 1.443 -0.807 0 C-N-CA 125.897 1.679 . . . . 0.0 108.593 -177.238 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 72.3 mt -126.73 147.8 49.94 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 -175.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -158.91 131.14 6.7 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 104.652 -2.351 . . . . 0.0 104.652 -167.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.403 ' CD1' HD11 ' A' ' 61' ' ' LEU . 52.8 m-85 -60.07 144.08 50.46 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 -176.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.11 8.28 66.94 Favored Glycine 0 N--CA 1.443 -0.848 0 CA-C-O 118.292 -1.282 . . . . 0.0 114.812 -179.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.47 -9.76 14.31 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.542 1.937 . . . . 0.0 115.207 -174.029 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 15.8 ttmt 51.09 135.55 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.08 1 C-N-CA 132.025 4.13 . . . . 0.0 115.66 174.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 11.5 mt -129.38 157.57 41.58 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 121.088 -1.007 . . . . 0.0 109.568 174.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 37.4 t -135.26 141.35 42.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 127.476 2.31 . . . . 0.0 106.026 173.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -118.1 179.63 4.04 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.803 1.641 . . . . 0.0 111.781 172.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 98.5 p -61.12 -27.3 68.28 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.876 1.271 . . . . 0.0 113.653 -175.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.415 HD22 ' CG1' ' A' ' 12' ' ' ILE . 14.1 m-80 -82.73 1.22 39.84 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 125.64 1.576 . . . . 0.0 110.745 178.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 61.3 23.73 13.92 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.542 1.537 . . . . 0.0 110.405 -170.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 27.8 m170 -61.08 124.04 19.39 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 120.699 1.59 . . . . 0.0 107.515 164.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -88.5 145.85 25.51 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 107.138 -1.431 . . . . 0.0 107.138 166.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -135.99 155.69 49.87 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.192 0.997 . . . . 0.0 109.028 174.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 40.0 t -141.62 131.63 25.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 C-N-CA 128.046 2.538 . . . . 0.0 107.074 -177.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.403 HD11 ' CD1' ' A' ' 47' ' ' TYR . 0.2 OUTLIER -74.55 123.33 24.6 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 107.159 -1.422 . . . . 0.0 107.159 169.436 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -110.54 167.31 10.31 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.225 0.921 . . . . 0.0 109.438 173.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -59.54 -4.16 0.58 Allowed 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.848 1.259 . . . . 0.0 113.643 178.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -77.87 -2.73 38.11 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 120.606 -1.309 . . . . 0.0 111.755 167.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 70.68 -3.0 2.06 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 126.613 1.965 . . . . 0.0 112.286 -178.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -89.1 166.17 14.03 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 123.604 0.762 . . . . 0.0 110.737 175.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 68.5 m95 -107.35 97.41 7.17 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 125.616 1.567 . . . . 0.0 107.012 173.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 54.9 t-80 -79.81 145.09 61.28 Favored Pre-proline 0 CA--C 1.543 0.705 0 CA-C-O 118.122 -0.942 . . . . 0.0 110.222 -175.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -68.47 109.0 1.94 Allowed 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 124.166 3.244 . . . . 0.0 112.5 172.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.0 21.05 0.59 Allowed 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.287 1.435 . . . . 0.0 111.858 170.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 67.17 165.85 0.12 Allowed Pre-proline 0 C--O 1.237 0.434 0 C-N-CA 127.3 2.24 . . . . 0.0 111.817 -176.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -65.05 163.9 26.99 Favored 'Trans proline' 0 N--CA 1.447 -1.23 0 C-N-CA 120.81 1.007 . . . . 0.0 112.39 174.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 15.8 tp -118.95 146.75 40.95 Favored Pre-proline 0 CA--C 1.535 0.39 0 C-N-CA 126.279 1.832 . . . . 0.0 110.102 -173.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.49 164.35 31.23 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 122.278 1.985 . . . . 0.0 111.523 173.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -59.02 -33.54 98.77 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.843 2.362 . . . . 0.0 112.353 178.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -77.58 -24.71 49.7 Favored 'General case' 0 N--CA 1.454 -0.239 0 O-C-N 121.697 -0.627 . . . . 0.0 111.239 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -64.43 -29.13 74.25 Favored Glycine 0 CA--C 1.532 1.127 0 CA-C-N 118.4 0.545 . . . . 0.0 112.396 -174.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 37.5 tp -55.73 -53.0 61.98 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 124.871 1.268 . . . . 0.0 109.638 169.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -64.25 -25.78 68.21 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.255 0.622 . . . . 0.0 111.3 -173.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -72.26 -20.41 61.53 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.761 0.824 . . . . 0.0 112.521 177.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 67.1 mt -83.17 -50.22 8.67 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 118.924 0.784 . . . . 0.0 109.026 168.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.8 mm -50.87 -40.28 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 126.094 1.758 . . . . 0.0 111.655 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.82 -41.81 7.33 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 125.104 1.362 . . . . 0.0 110.751 176.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -73.78 -44.77 55.02 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -178.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 5.6 t60 -62.87 -45.06 94.32 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 119.682 1.128 . . . . 0.0 108.843 177.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 91.9 m -62.69 -41.05 98.92 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.484 177.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.69 -33.31 73.74 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -178.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 9.2 t -74.4 -38.89 62.98 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.971 0.805 . . . . 0.0 109.042 -177.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 78.4 mt -87.41 -52.11 5.55 Favored 'General case' 0 N--CA 1.462 0.166 0 O-C-N 121.659 -0.651 . . . . 0.0 109.772 -173.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 115.98 58.06 0.33 Allowed Glycine 0 CA--C 1.523 0.535 0 C-N-CA 125.971 1.748 . . . . 0.0 108.918 -179.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 13.3 m-70 -115.32 164.61 14.0 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 123.777 0.831 . . . . 0.0 110.895 -175.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 64.2 m -114.51 -164.9 0.97 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.795 1.238 . . . . 0.0 111.106 -170.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 1.2 p -129.42 103.54 6.97 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 125.068 1.347 . . . . 0.0 109.348 -163.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 8.3 t -80.8 74.34 7.76 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 127.006 2.122 . . . . 0.0 109.257 -175.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 27.1 t 64.89 172.38 0.2 Allowed 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.303 1.441 . . . . 0.0 111.508 -177.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 2.4 mptp? 48.49 -164.31 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.524 1.13 . . . . 0.0 109.691 -158.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 7.4 mtm -68.21 -16.52 64.01 Favored 'General case' 0 N--CA 1.463 0.214 0 O-C-N 120.999 -1.063 . . . . 0.0 112.817 177.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -168.43 -50.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 126.94 2.096 . . . . 0.0 110.463 -178.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 89.7 mt -154.3 163.38 40.23 Favored 'General case' 0 CA--C 1.514 -0.433 0 C-N-CA 127.119 2.168 . . . . 0.0 109.88 -170.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 16.0 t-160 -86.56 -37.39 18.2 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 123.692 0.797 . . . . 0.0 112.644 169.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 4.5 t -172.41 -178.92 2.11 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 118.582 0.628 . . . . 0.0 112.684 -165.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 45.2 t -68.05 -39.82 82.11 Favored 'Isoleucine or valine' 0 C--N 1.345 0.371 0 C-N-CA 124.048 0.939 . . . . 0.0 111.194 -179.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -59.89 -44.89 93.98 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 177.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.55 -49.71 67.09 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 127.388 2.275 . . . . 0.0 109.968 174.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.21 -56.29 24.0 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 124.924 1.29 . . . . 0.0 111.28 179.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 3.4 mm -60.17 -41.07 85.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -174.106 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -59.98 -50.05 75.27 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 124.032 0.933 . . . . 0.0 110.25 176.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -54.5 -67.46 0.26 Allowed 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 126.666 1.986 . . . . 0.0 110.022 178.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 6.9 mp -47.48 -49.95 24.44 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 125.266 1.426 . . . . 0.0 111.681 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 63.3 m-80 -79.44 -4.79 52.77 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -176.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -99.15 -25.59 14.48 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 119.559 1.072 . . . . 0.0 111.169 169.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 40.3 mt -62.8 -60.28 3.71 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 174.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -72.54 154.11 40.98 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 123.96 0.788 . . . . 0.0 111.349 -169.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.106 0 N-CA-C 106.864 -2.494 . . . . 0.0 106.864 -176.72 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.4 ptp . . . . . 0 N--CA 1.473 0.694 0 CA-C-O 119.78 -0.152 . . . . 0.0 110.814 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 64.96 -172.0 21.62 Favored Glycine 0 CA--C 1.537 1.46 0 O-C-N 121.786 -0.571 . . . . 0.0 113.403 176.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -50.73 129.34 22.71 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 126.815 2.046 . . . . 0.0 111.568 -171.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 137.89 -72.06 0.45 Allowed Glycine 0 CA--C 1.519 0.289 0 N-CA-C 108.742 -1.743 . . . . 0.0 108.742 -164.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -84.5 9.72 12.76 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 27.2 p -122.86 151.01 60.21 Favored Pre-proline 0 C--O 1.238 0.457 0 C-N-CA 124.065 0.946 . . . . 0.0 111.717 -176.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -74.53 95.66 0.95 Allowed 'Trans proline' 0 N--CA 1.45 -1.08 0 C-N-CA 123.244 2.63 . . . . 0.0 109.487 178.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 75.6 144.51 0.1 Allowed Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 128.294 2.638 . . . . 0.0 113.964 176.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -80.03 -20.56 8.69 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 122.877 2.385 . . . . 0.0 114.201 -178.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -78.12 -18.59 55.46 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 117.295 -1.336 . . . . 0.0 111.527 172.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 tt -60.89 127.0 29.44 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 121.276 1.853 . . . . 0.0 110.831 -174.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 44.6 mm -111.73 118.59 57.96 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.096 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 178.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 63.7 m95 -64.53 152.85 88.47 Favored Pre-proline 0 C--O 1.237 0.411 0 CA-C-O 118.53 -0.748 . . . . 0.0 110.5 173.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -70.17 160.2 89.66 Favored 'Cis proline' 0 N--CA 1.458 -0.593 0 C-N-CA 124.697 -0.96 . . . . 0.0 113.717 -1.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -119.6 168.36 11.1 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.972 0.909 . . . . 0.0 109.687 174.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 16.0 mt -140.25 91.25 2.43 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.885 2.074 . . . . 0.0 107.1 -179.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 26.8 tp -68.34 144.86 54.64 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 106.234 -1.765 . . . . 0.0 106.234 160.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -143.11 95.64 2.8 Favored 'General case' 0 CA--C 1.506 -0.743 0 N-CA-C 103.776 -2.675 . . . . 0.0 103.776 167.204 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.47 HE22 ' HB3' ' A' ' 44' ' ' LEU . 8.1 mt-30 -55.06 137.43 46.47 Favored 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 124.717 1.261 . . . . 0.0 109.861 -167.637 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.8 134.33 56.59 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-O 122.449 1.119 . . . . 0.0 109.051 175.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 97.73 -45.69 1.7 Allowed Glycine 0 CA--C 1.526 0.741 0 C-N-CA 126.251 1.881 . . . . 0.0 111.446 -172.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 66.3 m -68.44 165.59 18.57 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 118.216 1.008 . . . . 0.0 109.983 174.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -116.48 -29.3 6.2 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.407 1.483 . . . . 0.0 108.267 173.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -64.98 144.98 56.93 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 127.426 2.29 . . . . 0.0 109.738 174.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.1 mt -99.98 161.43 13.61 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 125.885 1.674 . . . . 0.0 110.152 -176.289 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -115.05 85.96 13.0 Favored Pre-proline 0 C--O 1.236 0.345 0 C-N-CA 125.201 1.4 . . . . 0.0 108.622 164.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -65.88 135.22 40.33 Favored 'Trans proline' 0 N--CA 1.453 -0.905 0 C-N-CA 121.987 1.791 . . . . 0.0 108.502 168.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.5 mt -134.2 100.45 4.7 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 -177.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.6 mtt180 -58.92 -47.39 85.18 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.144 0.497 . . . . 0.0 111.175 -168.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 66.3 p -141.87 175.98 9.29 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -172.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -54.13 -36.48 63.32 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-O 119.132 -0.461 . . . . 0.0 110.446 166.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -67.38 -16.77 64.43 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -174.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -80.95 -43.93 18.99 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.345 1.058 . . . . 0.0 109.647 171.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 76.4 t-105 -64.89 -37.82 88.91 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.144 0.978 . . . . 0.0 111.877 176.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.9 mm100 -52.61 -48.47 66.31 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 124.666 1.187 . . . . 0.0 109.055 177.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 45.4 mtp85 -61.94 -31.69 72.04 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 124.839 1.256 . . . . 0.0 112.236 179.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -73.79 -54.22 8.52 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.262 0.625 . . . . 0.0 109.806 -178.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 23.8 t -65.57 -24.02 66.99 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.545 0.738 . . . . 0.0 112.276 176.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.93 -46.73 70.68 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.365 1.066 . . . . 0.0 109.985 172.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -114.66 73.3 0.82 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-O 122.252 1.025 . . . . 0.0 111.253 -157.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 36.8 m 70.97 107.5 0.06 Allowed 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 127.008 2.123 . . . . 0.0 110.383 177.134 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.3 -17.75 0.17 Allowed 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 127.51 2.324 . . . . 0.0 116.864 -173.325 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 73.92 -170.04 0.11 Allowed 'General case' 0 C--O 1.238 0.488 0 C-N-CA 125.379 1.472 . . . . 0.0 113.437 164.701 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.47 ' HB3' HE22 ' A' ' 19' ' ' GLN . 4.8 mt -70.29 123.62 22.15 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 106.838 -1.541 . . . . 0.0 106.838 174.327 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 93.5 mt -139.71 143.58 37.12 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 105.63 -1.989 . . . . 0.0 105.63 171.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 26.3 pt20 -157.6 130.33 7.45 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 104.628 -2.36 . . . . 0.0 104.628 -173.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -56.87 132.53 52.79 Favored 'General case' 0 C--O 1.243 0.733 0 N-CA-C 105.554 -2.017 . . . . 0.0 105.554 175.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 100.76 -0.25 55.29 Favored Glycine 0 CA--C 1.534 1.264 0 CA-C-O 118.989 -0.895 . . . . 0.0 115.239 -176.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.58 -19.87 28.59 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 119.874 1.837 . . . . 0.0 115.282 -174.214 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt 62.13 136.37 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 129.786 3.234 . . . . 0.0 113.718 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 8.4 tp -126.76 153.0 46.13 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 174.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 27.5 t -132.67 128.83 57.99 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 N-CA-C 103.783 -2.673 . . . . 0.0 103.783 172.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -97.23 177.76 5.46 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 122.06 0.933 . . . . 0.0 110.748 168.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.1 t -60.65 -19.88 59.37 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.162 1.385 . . . . 0.0 112.763 -178.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -84.32 -14.08 50.66 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 120.535 1.516 . . . . 0.0 113.084 -176.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 67.85 41.65 2.1 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 118.853 0.751 . . . . 0.0 109.72 -158.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 31.6 m170 -91.78 127.64 37.32 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 154.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -90.07 159.44 16.82 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 173.04 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -144.48 161.02 40.11 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 123.43 0.692 . . . . 0.0 110.539 177.301 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 25.7 t -139.07 131.05 36.33 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 128.096 2.558 . . . . 0.0 106.881 177.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.07 130.67 38.69 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 105.936 -1.875 . . . . 0.0 105.936 171.878 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -123.27 166.83 14.6 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.194 1.397 . . . . 0.0 109.692 177.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -57.74 -27.91 63.42 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 119.861 -1.774 . . . . 0.0 114.86 -166.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -75.39 15.11 0.49 Allowed 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 128.803 2.841 . . . . 0.0 112.369 177.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 68.7 9.23 7.22 Favored 'General case' 0 C--N 1.355 0.825 0 C-N-CA 125.61 1.564 . . . . 0.0 113.231 167.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 3.3 p-80 -101.31 159.48 15.23 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 122.386 1.089 . . . . 0.0 111.396 172.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 82.2 m95 -97.49 97.75 9.35 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 105.867 -1.901 . . . . 0.0 105.867 168.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 38.5 t-80 -71.28 143.77 88.63 Favored Pre-proline 0 CA--C 1.538 0.511 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 175.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -68.38 105.83 1.31 Allowed 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.314 2.676 . . . . 0.0 108.97 173.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.67 43.74 0.69 Allowed 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 126.03 1.732 . . . . 0.0 110.892 -176.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 60.73 166.47 0.09 OUTLIER Pre-proline 0 CA--C 1.542 0.637 0 C-N-CA 125.666 1.586 . . . . 0.0 111.942 -167.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -64.13 177.42 1.99 Allowed 'Trans proline' 0 N--CA 1.451 -1.002 0 C-N-CA 121.122 1.215 . . . . 0.0 111.977 168.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 6.0 tt -122.61 143.46 39.96 Favored Pre-proline 0 CA--C 1.534 0.347 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -79.73 165.27 22.59 Favored 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 122.085 1.857 . . . . 0.0 110.662 -175.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -65.17 -15.63 51.17 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 121.689 1.593 . . . . 0.0 113.248 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -89.32 -27.36 20.57 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.965 0.906 . . . . 0.0 112.925 172.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.54 -36.43 89.36 Favored Glycine 0 C--N 1.344 1.003 0 C-N-CA 124.738 1.161 . . . . 0.0 112.404 -166.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.0 tp -57.61 -48.24 79.96 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 125.687 1.595 . . . . 0.0 108.445 -178.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -62.29 -25.77 68.04 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 118.137 -0.935 . . . . 0.0 112.574 -173.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -72.61 -37.05 68.19 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.486 1.039 . . . . 0.0 111.551 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.4 mp -65.27 -49.98 67.51 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.837 0.855 . . . . 0.0 110.321 173.143 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 15.4 mm -52.19 -42.59 36.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 125.228 1.411 . . . . 0.0 109.178 174.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.4 ttt-85 -52.66 -18.04 1.6 Allowed 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 126.919 2.088 . . . . 0.0 114.61 175.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -90.1 -51.68 5.34 Favored 'General case' 0 CA--C 1.527 0.079 0 CA-C-N 120.235 1.379 . . . . 0.0 110.859 176.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -57.59 -48.15 80.19 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 121.958 0.885 . . . . 0.0 110.317 175.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 90.3 m -66.86 -36.66 82.82 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 121.52 -0.737 . . . . 0.0 110.877 -177.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.53 -46.72 84.7 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 118.521 0.601 . . . . 0.0 111.176 175.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.5 t -68.55 -31.44 70.66 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -172.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 91.0 mt -79.87 -57.44 3.65 Favored 'General case' 0 N--CA 1.463 0.185 0 O-C-N 121.06 -1.025 . . . . 0.0 110.619 176.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 127.25 39.66 0.37 Allowed Glycine 0 CA--C 1.533 1.18 0 C-N-CA 125.756 1.646 . . . . 0.0 112.853 -177.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 65.8 m-70 -120.27 169.21 10.48 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 119.21 1.505 . . . . 0.0 110.511 -177.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 8.0 t -150.73 170.41 19.3 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.27 1.028 . . . . 0.0 110.874 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 92.0 m -58.17 153.51 14.83 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 127.441 2.296 . . . . 0.0 111.852 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -116.72 -85.75 0.63 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.677 1.591 . . . . 0.0 107.971 -173.425 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -140.66 -174.19 3.9 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 126.97 2.108 . . . . 0.0 108.179 179.411 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 30.2 tptt 48.68 54.59 10.39 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 125.705 1.602 . . . . 0.0 112.624 171.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 6.8 tpt 53.92 37.14 25.98 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.657 0.783 . . . . 0.0 110.561 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 62.69 -61.83 0.12 Allowed 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 126.62 1.968 . . . . 0.0 111.458 -160.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 97.7 mt -135.42 116.9 14.76 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 125.231 1.412 . . . . 0.0 109.169 -156.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 10.6 t-80 -75.19 -26.31 58.91 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 172.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 79.1 p -159.21 172.98 17.07 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 119.481 1.037 . . . . 0.0 112.015 177.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 47.5 t -58.14 -43.46 85.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.261 166.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 1.2 ttm -55.85 -50.04 71.68 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 118.995 0.816 . . . . 0.0 110.355 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.41 -29.85 69.46 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 120.704 -0.398 . . . . 0.0 110.168 -178.31 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -69.27 -42.77 75.11 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 124.802 1.241 . . . . 0.0 112.823 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 32.7 mm -54.95 -39.86 51.0 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 172.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -69.34 -44.6 71.32 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 119.438 -0.315 . . . . 0.0 111.032 -178.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -57.71 -44.47 85.94 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.257 1.023 . . . . 0.0 111.001 176.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 12.4 mt -54.61 -35.97 63.97 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 124.929 1.292 . . . . 0.0 112.136 173.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -88.58 0.62 56.17 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.438 1.495 . . . . 0.0 112.516 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -112.92 3.52 16.34 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.872 1.669 . . . . 0.0 112.281 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 15.5 mt -76.66 -38.84 53.89 Favored 'General case' 0 CA--C 1.527 0.07 0 C-N-CA 123.439 0.695 . . . . 0.0 109.809 167.074 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -66.75 163.24 19.63 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.805 1.242 . . . . 0.0 110.363 169.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.995 0 CA-C-O 117.488 -1.729 . . . . 0.0 108.827 -174.79 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.9 mmm . . . . . 0 N--CA 1.471 0.595 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 75.87 -117.63 5.18 Favored Glycine 0 C--N 1.333 0.399 0 N-CA-C 110.178 -1.169 . . . . 0.0 110.178 175.05 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -74.04 179.8 4.19 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.654 0.781 . . . . 0.0 111.5 175.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 154.51 -30.55 0.69 Allowed Glycine 0 CA--C 1.522 0.488 0 C-N-CA 125.158 1.361 . . . . 0.0 112.126 167.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 14.8 mt-30 60.01 17.69 6.92 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.329 1.852 . . . . 0.0 113.964 172.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 19.5 p -129.85 163.59 46.08 Favored Pre-proline 0 C--O 1.237 0.411 0 C-N-CA 128.617 2.767 . . . . 0.0 109.19 -176.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -81.9 83.32 2.11 Favored 'Trans proline' 0 N--CA 1.444 -1.44 0 C-N-CA 121.723 1.616 . . . . 0.0 109.172 173.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 74.9 149.33 0.12 Allowed Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 127.706 2.402 . . . . 0.0 111.164 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -73.42 -34.0 6.34 Favored 'Trans proline' 0 CA--C 1.534 0.497 0 C-N-CA 122.007 1.804 . . . . 0.0 112.806 173.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -76.47 -11.89 59.95 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 118.807 0.73 . . . . 0.0 112.892 -171.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 tt -61.2 142.37 56.83 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.302 0.641 . . . . 0.0 110.066 167.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 34.1 mm -124.96 117.77 51.14 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 173.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 81.4 m95 -61.22 151.63 75.25 Favored Pre-proline 0 C--O 1.235 0.323 0 C-N-CA 122.771 0.429 . . . . 0.0 110.779 177.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -73.24 168.14 76.87 Favored 'Cis proline' 0 N--CA 1.457 -0.637 0 C-N-CA 125.122 -0.783 . . . . 0.0 114.027 -1.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -137.06 172.91 12.3 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.332 1.053 . . . . 0.0 110.685 177.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 17.2 mt -141.41 105.97 4.88 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 126.246 1.818 . . . . 0.0 108.681 -171.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 32.5 tp -87.92 150.35 23.53 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 125.262 1.425 . . . . 0.0 109.913 174.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -144.53 83.19 1.71 Allowed 'General case' 0 C--O 1.239 0.501 0 CA-C-N 120.176 1.353 . . . . 0.0 110.391 172.567 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -47.77 140.91 5.99 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 125.889 1.676 . . . . 0.0 113.296 -170.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -62.94 117.52 6.52 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.612 0.72 . . . . 0.0 110.642 -179.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 119.39 -62.21 0.47 Allowed Glycine 0 N--CA 1.451 -0.355 0 N-CA-C 108.575 -1.81 . . . . 0.0 108.575 -170.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -76.1 -179.75 5.16 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 123.434 1.588 . . . . 0.0 112.663 -166.763 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -124.78 -16.72 6.1 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 126.075 1.75 . . . . 0.0 109.319 176.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -77.47 109.98 11.86 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 -174.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.417 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 0.5 OUTLIER -65.65 148.3 51.98 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 119.604 -0.838 . . . . 0.0 108.947 172.419 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -104.34 87.68 1.78 Allowed Pre-proline 0 N--CA 1.447 -0.619 0 C-N-CA 126.314 1.846 . . . . 0.0 106.45 173.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -61.91 132.45 39.73 Favored 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 121.949 1.766 . . . . 0.0 108.526 170.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -118.61 103.28 9.56 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.923 1.289 . . . . 0.0 107.577 174.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 30.0 mtt180 -66.87 -38.99 87.37 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 119.415 1.007 . . . . 0.0 112.754 -169.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 15.5 p -152.55 166.81 30.87 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 126.367 1.867 . . . . 0.0 106.95 -170.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -47.75 -37.85 14.24 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.501 1.046 . . . . 0.0 112.636 175.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.02 -17.9 29.53 Favored 'General case' 0 C--O 1.231 0.095 0 C-N-CA 125.354 1.462 . . . . 0.0 114.275 -177.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -87.09 -47.28 9.04 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.479 1.912 . . . . 0.0 110.274 -175.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 53.4 t-105 -58.21 -34.69 70.67 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 120.659 -1.276 . . . . 0.0 110.267 176.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -51.21 -48.35 62.04 Favored 'General case' 0 C--N 1.341 0.234 0 C-N-CA 123.635 0.774 . . . . 0.0 110.105 173.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 5.2 mtt180 -67.14 -21.88 65.8 Favored 'General case' 0 CA--C 1.517 -0.322 0 C-N-CA 125.711 1.604 . . . . 0.0 112.225 -169.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -69.52 -68.32 0.42 Allowed 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 69.1 m -67.18 -17.17 64.72 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -175.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.77 -9.46 37.19 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.424 1.09 . . . . 0.0 111.78 170.291 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -122.77 55.76 1.17 Allowed 'General case' 0 C--O 1.233 0.207 0 CA-C-O 122.952 1.358 . . . . 0.0 110.014 172.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.2 t 71.69 160.23 0.22 Allowed 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 128.64 2.776 . . . . 0.0 111.029 -172.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -102.3 46.58 0.92 Allowed 'General case' 0 C--O 1.237 0.399 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 176.151 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -67.07 172.64 4.37 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 107.422 -1.325 . . . . 0.0 107.422 174.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . 0.326 36.9 mt 62.12 -154.98 0.35 Allowed 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.972 0.909 . . . . 0.0 111.952 174.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.463 ' N ' HE21 ' A' ' 46' ' ' GLN . 31.2 mt 75.68 84.51 0.09 Allowed 'General case' 0 C--N 1.34 0.161 0 C-N-CA 125.365 1.466 . . . . 0.0 112.373 163.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.463 HE21 ' N ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -104.11 165.66 10.91 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.301 1.04 . . . . 0.0 111.06 -169.896 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 17.7 m-85 -73.08 79.29 1.23 Allowed 'General case' 0 C--O 1.234 0.264 0 C-N-CA 125.485 1.514 . . . . 0.0 109.711 177.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 150.84 -0.75 0.37 Allowed Glycine 0 N--CA 1.446 -0.696 0 CA-C-N 115.003 -0.999 . . . . 0.0 113.022 -167.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.04 -9.4 38.76 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 119.41 1.605 . . . . 0.0 114.621 -168.172 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt 44.23 126.44 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.785 1 C-N-CA 132.993 4.517 . . . . 0.0 114.837 179.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.0 tp -120.04 151.21 39.34 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 124.283 1.033 . . . . 0.0 108.252 170.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 33.8 t -134.8 146.27 31.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 105.535 -2.024 . . . . 0.0 105.535 161.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -120.95 -171.11 2.13 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 127.782 2.433 . . . . 0.0 110.701 178.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 88.8 p -63.93 -29.17 70.37 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -72.47 -14.72 61.74 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 124.121 0.968 . . . . 0.0 112.305 -178.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 51.15 57.33 6.75 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.196 0.999 . . . . 0.0 111.406 -177.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 11.0 m170 -120.75 13.02 11.49 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.377 1.071 . . . . 0.0 113.693 -171.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 57.0 m 43.05 124.99 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.541 1 C-N-CA 133.624 4.77 . . . . 0.0 113.573 176.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -126.54 141.88 51.72 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 121.362 -0.836 . . . . 0.0 109.171 178.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 30.5 t -130.9 146.13 34.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 C-N-CA 127.243 2.217 . . . . 0.0 105.698 169.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 21.4 tp -77.19 139.1 39.81 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 124.184 0.994 . . . . 0.0 108.607 177.104 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -108.0 167.2 10.16 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 125.789 1.636 . . . . 0.0 109.67 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -69.72 -9.85 56.02 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.82 0.848 . . . . 0.0 112.493 176.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.3 t0 -81.78 6.6 15.01 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.562 1.545 . . . . 0.0 111.087 166.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 53.01 8.25 0.09 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 128.053 2.541 . . . . 0.0 114.29 -169.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.2 p-80 -79.26 165.91 22.71 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 119.435 1.016 . . . . 0.0 109.405 169.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 75.6 m95 -102.45 122.31 44.07 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 106.838 -1.541 . . . . 0.0 106.838 170.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 63.0 t60 -98.99 143.68 26.82 Favored Pre-proline 0 CA--C 1.536 0.431 0 CA-C-O 118.379 -0.819 . . . . 0.0 109.186 -176.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -74.52 125.26 9.46 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 124.109 3.206 . . . . 0.0 110.754 173.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -116.72 39.33 3.21 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 125.021 1.328 . . . . 0.0 110.426 -168.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 67.61 164.35 0.13 Allowed Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 127.98 2.512 . . . . 0.0 111.949 -178.162 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -69.7 174.27 9.71 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.201 1.934 . . . . 0.0 114.26 -172.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.3 tt -128.75 143.64 49.32 Favored Pre-proline 0 CA--C 1.542 0.652 0 C-N-CA 126.663 1.985 . . . . 0.0 108.411 -175.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -85.6 165.45 10.57 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 123.14 2.56 . . . . 0.0 112.977 -178.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -60.15 -14.06 26.94 Favored 'Trans proline' 0 CA--C 1.531 0.361 0 C-N-CA 123.383 2.722 . . . . 0.0 114.77 177.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -101.31 -14.24 17.71 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.251 1.82 . . . . 0.0 112.493 177.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -75.22 -25.59 68.25 Favored Glycine 0 CA--C 1.53 1.003 0 O-C-N 121.133 -0.98 . . . . 0.0 112.916 -177.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 23.0 tp -50.75 -48.69 59.07 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 118.359 1.08 . . . . 0.0 109.333 166.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -68.31 -21.45 64.77 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.931 -168.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -69.31 -43.55 73.54 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 120.398 1.454 . . . . 0.0 111.565 172.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -60.34 -55.4 34.15 Favored 'General case' 0 CA--C 1.522 -0.098 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 175.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.8 mm -58.3 -33.28 47.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 123.609 0.763 . . . . 0.0 110.605 -176.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.9 -35.56 45.86 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 119.429 1.013 . . . . 0.0 112.219 175.668 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.26 -61.45 2.35 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 119.212 0.915 . . . . 0.0 109.365 176.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.417 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 10.2 t60 -57.98 -36.56 72.78 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.876 0.871 . . . . 0.0 112.194 -175.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 96.7 m -70.39 -54.37 12.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 118.358 -0.83 . . . . 0.0 110.973 175.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.14 -24.99 65.06 Favored 'General case' 0 C--O 1.23 0.074 0 CA-C-N 118.862 0.755 . . . . 0.0 112.03 -171.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.4 t -76.85 -15.37 59.73 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 118.653 -0.689 . . . . 0.0 110.755 178.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 83.6 mt -114.77 -58.28 2.16 Favored 'General case' 0 C--N 1.343 0.324 0 CA-C-N 119.636 1.107 . . . . 0.0 110.6 -174.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 149.36 5.55 0.22 Allowed Glycine 0 CA--C 1.528 0.901 0 CA-C-O 118.93 -0.928 . . . . 0.0 113.9 -173.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 30.3 m170 -76.71 142.29 40.57 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 119.511 1.656 . . . . 0.0 110.74 -161.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 24.4 t -139.49 72.29 1.4 Allowed 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 124.229 1.012 . . . . 0.0 109.115 -174.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 96.1 m 60.13 176.91 0.09 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.521 1.929 . . . . 0.0 114.597 173.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 8.8 t -159.75 61.18 0.37 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 128.359 2.663 . . . . 0.0 109.053 -177.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.4 t 68.96 152.47 0.09 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.562 1.145 . . . . 0.0 111.088 179.05 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.8 ttpt 66.97 -177.2 0.2 Allowed 'General case' 0 N--CA 1.469 0.501 0 O-C-N 120.492 -1.38 . . . . 0.0 111.773 -176.039 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 4.6 tpt -73.78 86.5 1.71 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.488 1.515 . . . . 0.0 108.194 175.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 1.2 m80 55.8 -76.55 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 127.066 2.146 . . . . 0.0 112.384 -175.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 81.6 mt -147.19 133.67 19.74 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 125.829 1.652 . . . . 0.0 108.102 -173.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 47.1 t-80 -67.6 -42.9 81.72 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 124.294 0.996 . . . . 0.0 111.807 179.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -170.2 -179.2 3.03 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.243 1.417 . . . . 0.0 109.157 -173.387 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 16.0 t -59.26 -40.62 81.71 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 C-N-CA 123.824 0.85 . . . . 0.0 110.818 -175.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -54.15 -45.67 72.08 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.875 0.87 . . . . 0.0 109.829 178.401 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -63.12 -41.53 99.36 Favored 'General case' 0 C--N 1.333 -0.115 0 C-N-CA 124.746 1.218 . . . . 0.0 110.564 -178.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.56 -50.17 74.63 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 124.224 1.01 . . . . 0.0 111.135 178.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 14.0 mm -66.31 -37.09 78.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -174.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -61.91 -47.97 82.54 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 118.763 0.711 . . . . 0.0 110.168 174.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -52.83 -63.7 1.06 Allowed 'General case' 0 C--N 1.342 0.257 0 C-N-CA 125.323 1.449 . . . . 0.0 111.59 179.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.7 mp -51.43 -47.0 63.15 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.702 1.201 . . . . 0.0 110.993 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -73.28 -18.36 61.22 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 121.663 -0.648 . . . . 0.0 112.377 -178.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -85.48 -22.85 28.05 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.357 1.063 . . . . 0.0 111.418 176.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 22.5 mt -69.17 -61.5 1.77 Allowed 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.133 0.973 . . . . 0.0 109.065 172.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -63.18 159.72 17.02 Favored 'General case' 0 C--O 1.24 0.584 0 N-CA-C 114.042 1.127 . . . . 0.0 114.042 -170.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.808 0 CA-C-O 118.321 -1.266 . . . . 0.0 110.985 171.272 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.467 0.42 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 159.34 81.95 0.04 OUTLIER Glycine 0 N--CA 1.445 -0.729 0 N-CA-C 108.554 -1.818 . . . . 0.0 108.554 173.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.2 134.18 56.28 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-N 117.057 0.429 . . . . 0.0 110.54 -172.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 176.17 167.3 34.78 Favored Glycine 0 CA--C 1.521 0.453 0 C-N-CA 125.163 1.363 . . . . 0.0 110.435 178.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 60.59 9.48 2.13 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 126.7 2.0 . . . . 0.0 115.073 -177.185 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 10.3 p -64.78 154.56 85.21 Favored Pre-proline 0 C--N 1.321 -0.664 0 C-N-CA 125.066 1.346 . . . . 0.0 110.771 173.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -79.31 90.2 1.29 Allowed 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 123.865 3.043 . . . . 0.0 110.258 -178.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 74.54 144.72 0.11 Allowed Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 127.898 2.479 . . . . 0.0 111.194 -175.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -77.94 -20.41 11.69 Favored 'Trans proline' 0 CA--C 1.535 0.534 0 C-N-CA 122.349 2.032 . . . . 0.0 113.507 -178.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -90.22 -15.89 30.51 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.256 0.622 . . . . 0.0 112.634 -175.088 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.8 tt -62.74 142.49 58.12 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 118.936 0.789 . . . . 0.0 109.806 170.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 18.2 mm -126.95 136.47 60.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 C-N-CA 124.194 0.998 . . . . 0.0 108.607 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 75.1 m95 -77.94 156.86 79.56 Favored Pre-proline 0 CA--C 1.543 0.693 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 -178.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -67.34 163.33 74.14 Favored 'Cis proline' 0 N--CA 1.458 -0.568 0 C-N-CA 124.633 -0.986 . . . . 0.0 113.355 -9.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -131.79 171.22 13.79 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.218 1.807 . . . . 0.0 110.016 176.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.7 mt -141.52 107.13 5.07 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 125.611 1.564 . . . . 0.0 107.63 -174.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.1 tp -84.14 151.27 24.99 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 169.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.472 ' HE3' ' O ' ' A' ' 22' ' ' CYS . 0.1 OUTLIER -142.58 91.5 2.32 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 171.894 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -48.31 136.0 12.92 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 124.522 1.139 . . . . 0.0 110.939 -168.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -66.28 91.5 0.17 Allowed 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 122.122 0.963 . . . . 0.0 111.808 -172.172 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 137.73 -40.43 1.49 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 124.942 1.258 . . . . 0.0 110.308 -178.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.472 ' O ' ' HE3' ' A' ' 18' ' ' LYS . 62.7 m -65.71 173.16 2.97 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 121.544 0.687 . . . . 0.0 110.281 177.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -122.04 -32.36 3.72 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 176.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -60.76 137.89 58.16 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 124.682 1.193 . . . . 0.0 108.417 170.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.4 mt -87.46 154.07 20.93 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 124.427 1.091 . . . . 0.0 108.987 168.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -111.91 86.72 7.71 Favored Pre-proline 0 CA--C 1.542 0.64 0 N-CA-C 105.847 -1.908 . . . . 0.0 105.847 175.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -60.56 140.74 92.81 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 123.936 3.091 . . . . 0.0 109.412 174.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.5 mt -132.89 96.69 3.84 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 106.654 -1.61 . . . . 0.0 106.654 -178.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.8 mtt-85 -53.7 -45.6 70.45 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 124.27 1.028 . . . . 0.0 110.882 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.4 t -157.19 178.14 10.68 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 -172.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -56.84 -34.65 67.97 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 123.716 0.807 . . . . 0.0 111.696 171.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -63.07 -17.74 62.61 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.539 1.063 . . . . 0.0 111.601 177.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -81.55 -44.71 16.93 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.689 1.596 . . . . 0.0 109.03 175.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 57.6 t-105 -57.72 -33.01 67.97 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.051 1.741 . . . . 0.0 112.481 174.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 -65.03 -50.25 66.96 Favored 'General case' 0 C--O 1.232 0.155 0 O-C-N 120.436 -1.415 . . . . 0.0 110.769 172.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 50.6 mtp85 -60.58 -31.74 70.87 Favored 'General case' 0 C--O 1.227 -0.119 0 CA-C-O 117.207 -1.378 . . . . 0.0 112.091 -175.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -49.93 -60.37 2.99 Favored 'General case' 0 N--CA 1.462 0.14 0 C-N-CA 124.42 1.088 . . . . 0.0 110.756 174.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 17.5 p -70.77 -35.07 72.43 Favored 'General case' 0 N--CA 1.453 -0.322 0 O-C-N 122.057 -0.402 . . . . 0.0 110.961 -174.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.05 -27.48 69.13 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 118.941 -0.552 . . . . 0.0 111.094 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -65.4 2.89 0.77 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.518 1.527 . . . . 0.0 113.277 -178.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.9 t 75.73 9.27 3.54 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 127.809 2.443 . . . . 0.0 110.46 -169.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -115.21 44.22 1.87 Allowed 'General case' 0 C--O 1.221 -0.441 0 C-N-CA 125.418 1.487 . . . . 0.0 112.286 -168.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -67.63 20.54 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 116.629 2.085 . . . . 0.0 116.629 -178.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.14 115.66 3.63 Favored 'General case' 0 N--CA 1.439 -0.977 0 C-N-CA 126.607 1.963 . . . . 0.0 110.087 -171.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 81.1 mt -144.37 126.24 15.32 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 -179.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -136.95 157.58 46.42 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 124.621 1.168 . . . . 0.0 109.545 -173.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -65.2 121.33 14.52 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 107.513 -1.291 . . . . 0.0 107.513 179.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 97.1 10.77 54.37 Favored Glycine 0 CA--C 1.535 1.299 0 CA-C-O 117.482 -1.732 . . . . 0.0 114.404 -177.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.3 -13.67 41.25 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-N 120.441 2.121 . . . . 0.0 115.466 178.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt 47.73 144.46 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.531 1 C-N-CA 134.815 5.246 . . . . 0.0 114.632 -176.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 14.8 mt -126.58 156.21 41.23 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 166.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 17.3 t -130.57 141.8 45.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 N-CA-C 104.552 -2.388 . . . . 0.0 104.552 163.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -98.66 179.78 4.56 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.276 1.03 . . . . 0.0 110.539 173.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.6 m -61.98 -3.09 1.07 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 115.881 1.808 . . . . 0.0 115.881 174.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 -120.79 16.2 11.84 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 127.04 2.136 . . . . 0.0 110.368 -176.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 65.33 13.94 9.11 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.819 2.048 . . . . 0.0 112.874 175.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 31.1 m170 -69.04 110.0 4.27 Favored 'General case' 0 C--N 1.329 -0.285 0 O-C-N 120.191 -1.568 . . . . 0.0 109.121 174.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -71.22 143.74 50.34 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 119.501 1.046 . . . . 0.0 108.76 167.524 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -135.65 159.49 41.47 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 125.397 1.479 . . . . 0.0 109.602 -179.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 30.3 t -141.64 141.33 30.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 C-N-CA 128.158 2.583 . . . . 0.0 105.961 -174.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 22.8 tp -94.42 132.73 38.76 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 128.299 2.64 . . . . 0.0 105.657 174.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 73.3 mt-10 -128.99 174.72 9.28 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.291 1.036 . . . . 0.0 112.11 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -68.38 -18.5 64.48 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 125.622 1.569 . . . . 0.0 114.516 -166.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -77.0 12.34 1.43 Allowed 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.067 1.347 . . . . 0.0 111.256 174.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 45.91 48.48 12.16 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 126.241 1.816 . . . . 0.0 109.693 -170.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -120.44 161.51 21.11 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.544 0.687 . . . . 0.0 110.876 162.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 81.6 m95 -94.75 154.56 17.23 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 106.043 -1.836 . . . . 0.0 106.043 158.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -142.46 161.34 50.45 Favored Pre-proline 0 CA--C 1.54 0.569 0 C-N-CA 123.935 0.894 . . . . 0.0 111.079 -176.02 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.04 134.42 27.35 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 124.313 3.342 . . . . 0.0 111.153 172.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -129.01 21.11 5.83 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.234 1.414 . . . . 0.0 112.833 -176.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 75.59 154.5 0.15 Allowed Pre-proline 0 CA--C 1.539 0.551 0 C-N-CA 131.479 3.912 . . . . 0.0 113.496 -177.22 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -72.0 163.58 38.34 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 121.756 1.638 . . . . 0.0 113.419 -176.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.4 tt -102.37 143.58 26.9 Favored Pre-proline 0 CA--C 1.545 0.762 0 C-N-CA 126.263 1.825 . . . . 0.0 109.273 -173.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -83.01 166.82 14.54 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 123.954 3.103 . . . . 0.0 111.706 -176.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -64.14 -21.27 67.84 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 121.626 1.551 . . . . 0.0 112.96 -175.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -90.34 -20.45 22.85 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.652 1.581 . . . . 0.0 112.928 175.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.02 -32.55 84.53 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-N 119.518 1.054 . . . . 0.0 111.104 -175.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 32.5 tp -59.67 -51.23 70.67 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.065 0.946 . . . . 0.0 108.511 178.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -61.28 -25.05 66.84 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.274 1.829 . . . . 0.0 111.061 178.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -76.43 -47.5 22.87 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.524 1.056 . . . . 0.0 111.029 176.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -61.2 -50.35 73.47 Favored 'General case' 0 CA--C 1.521 -0.16 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 177.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.7 mm -53.73 -42.24 50.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 C-N-CA 124.022 0.929 . . . . 0.0 109.672 -179.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.9 ttt85 -51.38 -38.57 54.01 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 120.017 1.28 . . . . 0.0 113.614 177.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.15 -49.64 75.06 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 119.774 1.17 . . . . 0.0 109.987 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 24.0 t60 -60.69 -46.0 92.05 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.863 0.865 . . . . 0.0 109.716 176.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 73.2 m -65.04 -34.47 78.51 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 118.297 -0.859 . . . . 0.0 111.886 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -71.45 -40.82 70.11 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 119.019 0.827 . . . . 0.0 111.122 -177.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 8.6 t -71.42 -35.04 70.82 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 118.989 -0.529 . . . . 0.0 110.187 -175.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 64.3 mt -78.42 -47.13 18.2 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 175.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 99.04 53.33 1.18 Allowed Glycine 0 CA--C 1.527 0.838 0 C-N-CA 127.247 2.356 . . . . 0.0 110.625 -178.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 35.3 m-70 -112.27 -178.7 3.48 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 126.118 1.767 . . . . 0.0 111.688 -177.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 5.3 m -117.58 161.13 20.12 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.94 1.296 . . . . 0.0 110.874 -172.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 29.3 p -70.98 22.86 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 126.787 2.035 . . . . 0.0 114.076 -179.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . 0.268 1.7 t 44.03 -87.94 0.01 OUTLIER 'General case' 0 C--O 1.237 0.403 0 C-N-CA 130.18 3.392 . . . . 0.0 111.9 -176.097 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 5.0 p -165.81 -164.23 0.7 Allowed 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 128.598 2.759 . . . . 0.0 105.753 171.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.6 ttpt 57.36 46.47 18.27 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.389 0.541 . . . . 0.0 112.173 165.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 37.4 ttp 59.8 46.08 11.87 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 124.486 1.115 . . . . 0.0 110.968 171.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 8.5 m80 62.75 -66.7 0.09 Allowed 'General case' 0 C--O 1.232 0.16 0 C-N-CA 127.373 2.269 . . . . 0.0 109.539 -159.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 94.1 mt -145.5 154.41 42.18 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 126.205 1.802 . . . . 0.0 108.503 -165.05 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -96.41 -28.78 14.29 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.127 -0.488 . . . . 0.0 112.271 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.6 t -171.63 179.85 2.72 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.432 1.493 . . . . 0.0 108.508 -177.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 60.6 t -65.21 -37.09 79.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 O-C-N 121.325 -0.859 . . . . 0.0 110.989 -177.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 3.7 tpt -59.05 -38.56 79.65 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 121.916 -0.49 . . . . 0.0 109.919 177.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -63.73 -44.31 93.94 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 124.27 1.028 . . . . 0.0 109.166 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -55.67 -52.0 65.32 Favored 'General case' 0 C--N 1.34 0.195 0 C-N-CA 125.599 1.56 . . . . 0.0 112.404 -178.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 30.0 mm -61.98 -44.08 98.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 -175.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.68 -40.78 92.71 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.151 0.58 . . . . 0.0 110.418 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -55.28 -55.17 34.5 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 124.318 1.047 . . . . 0.0 109.686 176.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 6.8 mt -61.64 -45.57 93.48 Favored 'General case' 0 CA--C 1.517 -0.315 0 O-C-N 124.182 0.926 . . . . 0.0 110.679 -176.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 -59.35 -43.41 92.81 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 118.988 -0.53 . . . . 0.0 110.065 179.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.8 -12.76 61.86 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 -177.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 57.2 mt -67.03 -63.57 1.03 Allowed 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 120.155 1.343 . . . . 0.0 109.162 177.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 54.34 32.95 17.39 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 128.688 2.795 . . . . 0.0 113.802 -179.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.206 0 C-N-CA 126.986 2.231 . . . . 0.0 108.607 172.19 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.6 ptp . . . . . 0 N--CA 1.474 0.77 0 CA-C-O 117.673 -1.156 . . . . 0.0 112.276 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -55.93 -62.28 6.49 Favored Glycine 0 C--N 1.341 0.823 0 CA-C-N 118.872 0.76 . . . . 0.0 111.791 -176.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 53.83 -154.32 0.25 Allowed 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 117.408 0.604 . . . . 0.0 110.883 -175.499 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -160.18 -168.42 22.1 Favored Glycine 0 CA--C 1.523 0.55 0 O-C-N 120.867 -1.146 . . . . 0.0 110.907 -177.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -134.58 86.23 2.25 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 -171.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -149.06 155.21 40.19 Favored Pre-proline 0 C--N 1.321 -0.658 0 C-N-CA 124.638 1.175 . . . . 0.0 110.816 -173.435 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -68.4 -54.66 0.28 Allowed 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.598 2.199 . . . . 0.0 111.931 176.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 20.3 t-80 -161.94 144.21 8.71 Favored Pre-proline 0 CA--C 1.536 0.427 0 CA-C-N 119.853 1.206 . . . . 0.0 108.661 174.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -73.64 -1.73 11.16 Favored 'Trans proline' 0 CA--C 1.536 0.609 0 C-N-CA 122.93 2.42 . . . . 0.0 114.216 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -113.11 -3.93 13.89 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.743 1.217 . . . . 0.0 112.23 177.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.7 tt -66.77 117.02 8.31 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 163.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 29.4 mm -100.05 103.9 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 177.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 71.9 m95 -53.47 150.51 12.28 Favored Pre-proline 0 CA--C 1.533 0.292 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.761 176.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -68.88 167.91 66.2 Favored 'Cis proline' 0 N--CA 1.456 -0.696 0 N-CA-C 114.878 1.069 . . . . 0.0 114.878 -0.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -139.23 167.78 21.3 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 124.831 1.252 . . . . 0.0 110.741 -179.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.5 mt -140.53 114.32 8.9 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 125.734 1.613 . . . . 0.0 108.488 -172.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.7 tp -95.7 143.77 26.67 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.602 1.561 . . . . 0.0 109.015 178.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -146.21 98.05 3.03 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 119.616 1.098 . . . . 0.0 110.769 175.485 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -58.87 160.31 5.99 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-O 122.687 1.232 . . . . 0.0 112.658 -173.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -76.12 99.87 4.8 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 122.63 1.205 . . . . 0.0 111.981 174.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 126.89 -39.43 1.97 Allowed Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 126.229 1.871 . . . . 0.0 108.506 169.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 41.6 m -65.67 165.07 13.18 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 124.568 1.147 . . . . 0.0 109.647 174.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 -122.16 -28.16 4.42 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 124.914 1.286 . . . . 0.0 109.539 -178.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -60.82 115.11 3.43 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 127.825 2.45 . . . . 0.0 109.177 -178.048 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -72.4 147.61 46.04 Favored 'General case' 0 N--CA 1.463 0.197 0 O-C-N 121.103 -0.998 . . . . 0.0 109.496 172.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.06 87.61 9.08 Favored Pre-proline 0 CA--C 1.535 0.369 0 C-N-CA 125.48 1.512 . . . . 0.0 108.945 176.084 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -63.48 127.54 20.15 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 122.641 2.227 . . . . 0.0 110.73 172.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -114.72 107.75 15.87 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 125.996 1.718 . . . . 0.0 107.604 169.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.7 mtt-85 -61.85 -45.79 92.29 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.045 0.384 . . . . 0.0 111.186 -178.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 13.3 t -146.85 -176.1 5.07 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 121.918 0.866 . . . . 0.0 110.54 174.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -54.44 -38.35 66.21 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 124.789 1.236 . . . . 0.0 110.085 -179.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.73 -19.85 63.54 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 121.423 0.63 . . . . 0.0 111.498 -177.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -78.47 -35.12 47.05 Favored 'General case' 0 CA--C 1.521 -0.164 0 O-C-N 120.151 -1.593 . . . . 0.0 109.923 175.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 49.9 t-105 -64.03 -34.93 79.12 Favored 'General case' 0 C--O 1.234 0.266 0 O-C-N 121.455 -0.778 . . . . 0.0 110.615 170.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -57.5 -57.15 13.96 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-O 118.834 -0.603 . . . . 0.0 109.771 168.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.83 -20.22 61.18 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 117.543 -1.663 . . . . 0.0 109.632 -168.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -52.15 -64.31 0.86 Allowed 'General case' 0 CA--C 1.519 -0.233 0 O-C-N 120.149 -1.594 . . . . 0.0 109.343 -177.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 1.9 m -80.48 -16.2 54.9 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-O 116.614 -1.66 . . . . 0.0 111.139 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -51.93 -45.46 64.3 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 120.344 1.429 . . . . 0.0 110.821 160.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -115.26 -4.74 12.38 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -156.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 8.1 t -144.81 -21.55 0.51 Allowed 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.628 1.171 . . . . 0.0 112.522 -174.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.2 pttt 44.47 26.1 0.16 Allowed 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 128.47 2.708 . . . . 0.0 115.351 176.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -60.33 150.84 29.36 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.88 0.848 . . . . 0.0 110.818 -159.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.1 tt -56.18 129.01 38.37 Favored 'General case' 0 N--CA 1.439 -0.99 0 C-N-CA 125.971 1.708 . . . . 0.0 110.022 175.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 57.9 mt -111.57 124.3 52.0 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.914 1.286 . . . . 0.0 107.646 -179.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -129.7 147.21 51.46 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.656 1.582 . . . . 0.0 107.943 -177.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.414 ' CD1' HD12 ' A' ' 61' ' ' LEU . 40.3 m-85 -67.16 91.32 0.22 Allowed 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 124.858 1.263 . . . . 0.0 110.629 -167.435 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 140.48 15.93 0.48 Allowed Glycine 0 CA--C 1.528 0.889 0 C-N-CA 124.203 0.906 . . . . 0.0 113.336 -179.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.13 -9.97 0.74 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 127.768 2.427 . . . . 0.0 115.321 171.779 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.2 ttmt 44.42 115.69 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 130.808 3.643 . . . . 0.0 113.737 175.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 16.1 mt -104.42 155.19 19.0 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 167.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 23.7 t -136.81 142.94 36.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 N-CA-C 105.952 -1.87 . . . . 0.0 105.952 160.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.406 ' CG ' ' H ' ' A' ' 55' ' ' ASN . 0.9 OUTLIER -104.68 -170.56 1.78 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.829 1.652 . . . . 0.0 111.018 179.126 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.6 m -72.55 -15.69 61.76 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 176.499 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.406 ' H ' ' CG ' ' A' ' 53' ' ' ASP . 21.6 m-80 -80.14 -3.95 50.93 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.829 1.251 . . . . 0.0 112.469 168.337 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 63.88 19.49 11.76 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.521 1.128 . . . . 0.0 109.88 -170.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 66.6 m170 -67.06 107.44 2.28 Favored 'General case' 0 CA--C 1.518 -0.266 0 O-C-N 120.215 -1.553 . . . . 0.0 106.918 170.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -74.04 153.86 39.49 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 121.952 0.882 . . . . 0.0 109.577 168.552 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -135.4 167.95 20.11 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 125.784 1.633 . . . . 0.0 108.511 -178.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 53.4 t -145.21 142.01 22.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 104.772 -2.307 . . . . 0.0 104.772 172.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.414 HD12 ' CD1' ' A' ' 47' ' ' TYR . 0.1 OUTLIER -81.6 124.53 29.62 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 106.379 -1.712 . . . . 0.0 106.379 170.461 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -109.21 161.25 15.41 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 118.516 0.598 . . . . 0.0 109.533 -178.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -55.84 -14.84 2.63 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -175.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.93 -11.04 57.98 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.937 1.295 . . . . 0.0 112.78 170.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 74.45 8.16 4.49 Favored 'General case' 0 C--N 1.351 0.643 0 C-N-CA 126.236 1.815 . . . . 0.0 111.193 -165.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -94.26 164.35 13.07 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 118.783 0.72 . . . . 0.0 111.403 177.081 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -107.96 107.28 17.91 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 107.645 -1.242 . . . . 0.0 107.645 173.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 -79.98 143.58 57.72 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -71.78 105.27 1.76 Allowed 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 124.606 3.537 . . . . 0.0 109.815 170.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.92 28.69 0.09 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.061 1.344 . . . . 0.0 111.559 170.026 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 67.8 166.71 0.12 Allowed Pre-proline 0 CA--C 1.539 0.53 0 C-N-CA 125.79 1.636 . . . . 0.0 111.602 -178.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -64.36 162.88 28.62 Favored 'Trans proline' 0 N--CA 1.45 -1.052 0 C-N-CA 120.47 0.78 . . . . 0.0 110.925 168.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 20.7 tp -122.67 144.63 43.01 Favored Pre-proline 0 N--CA 1.448 -0.575 0 C-N-CA 126.717 2.007 . . . . 0.0 106.262 -178.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -62.24 160.68 29.8 Favored 'Trans proline' 0 N--CA 1.453 -0.91 0 C-N-CA 121.608 1.538 . . . . 0.0 110.445 174.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -59.97 -25.12 78.72 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 122.28 1.987 . . . . 0.0 112.487 179.168 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -89.2 -20.04 24.68 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 126.549 1.94 . . . . 0.0 109.764 -174.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.06 -23.17 78.37 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 123.814 0.721 . . . . 0.0 112.432 176.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 27.9 tp -55.66 -46.99 77.42 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.311 1.044 . . . . 0.0 109.847 169.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . 0.49 ' ND2' ' HD1' ' A' ' 98' ' ' HIS . 1.6 m120 -58.45 -26.17 63.03 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.452 1.501 . . . . 0.0 111.379 -175.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -74.79 -24.35 58.64 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.18 1.392 . . . . 0.0 113.158 177.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 93.7 mt -84.94 -53.56 5.23 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 175.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.7 mm -56.74 -28.06 27.11 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 125.395 1.478 . . . . 0.0 110.258 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -44.14 -46.45 8.75 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 125.581 1.552 . . . . 0.0 111.172 174.418 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.73 -48.77 77.77 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 123.525 0.73 . . . . 0.0 111.718 -176.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 13.0 t60 -59.32 -46.62 88.11 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.368 0.667 . . . . 0.0 109.716 177.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 78.2 m -68.92 -31.99 71.28 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 120.896 -1.127 . . . . 0.0 111.129 -178.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -80.63 -12.51 59.49 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 125.111 1.365 . . . . 0.0 113.557 -179.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.0 t -95.57 -4.41 44.7 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.107 0.867 . . . . 0.0 110.981 170.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 88.9 mt -122.72 -46.84 2.1 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 119.89 1.223 . . . . 0.0 111.66 -174.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 119.95 57.59 0.25 Allowed Glycine 0 CA--C 1.528 0.891 0 C-N-CA 125.239 1.399 . . . . 0.0 112.529 178.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -130.84 159.77 36.38 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 118.975 1.388 . . . . 0.0 112.674 -179.183 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 96.4 m -138.22 -56.51 0.65 Allowed 'General case' 0 C--N 1.348 0.503 0 C-N-CA 124.38 1.072 . . . . 0.0 112.918 175.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 4.6 p 176.68 154.7 0.23 Allowed 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 126.438 1.895 . . . . 0.0 111.649 178.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 9.8 t -149.11 144.92 26.95 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.166 1.386 . . . . 0.0 108.348 -179.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 75.7 m 54.63 -63.48 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 128.268 2.627 . . . . 0.0 115.905 -174.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.545 ' HE3' ' HB2' ' A' ' 100' ' ' HIS . 0.0 OUTLIER -109.04 -158.03 0.63 Allowed 'General case' 0 C--O 1.238 0.477 0 C-N-CA 125.08 1.352 . . . . 0.0 109.257 -176.543 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 8.5 ttp -64.96 179.43 0.68 Allowed 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 172.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . 0.49 ' HD1' ' ND2' ' A' ' 79' ' ' ASN . 17.2 t-160 -44.58 -60.88 1.77 Allowed 'General case' 0 CA--C 1.519 -0.245 0 C-N-CA 126.584 1.953 . . . . 0.0 111.86 179.536 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 84.2 mt -138.85 146.76 41.6 Favored 'General case' 0 CA--C 1.514 -0.43 0 C-N-CA 124.647 1.179 . . . . 0.0 107.907 169.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . 0.545 ' HB2' ' HE3' ' A' ' 96' ' ' LYS . 12.1 t-80 -79.45 -36.31 39.06 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 124.557 1.143 . . . . 0.0 112.539 -179.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 24.2 p -170.64 174.0 5.19 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 126.18 1.792 . . . . 0.0 108.625 -177.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 68.7 t -62.62 -45.74 98.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-O 118.714 -0.66 . . . . 0.0 109.929 177.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 46.8 tpp -62.77 -46.05 89.82 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.843 1.201 . . . . 0.0 110.155 -177.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.29 -35.44 69.8 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 178.459 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.42 -41.77 98.94 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 123.652 0.781 . . . . 0.0 112.492 174.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 29.1 mm -56.02 -49.99 72.33 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-N 119.364 0.984 . . . . 0.0 108.889 -177.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.67 -40.73 63.47 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.123 -176.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -50.29 -59.16 4.24 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.535 0.734 . . . . 0.0 111.454 173.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 74.4 mt -58.29 -35.57 72.0 Favored 'General case' 0 CA--C 1.522 -0.125 0 C-N-CA 125.289 1.436 . . . . 0.0 112.159 -174.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -69.16 -46.12 68.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 119.227 -0.416 . . . . 0.0 110.355 174.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -69.61 -11.65 61.01 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.132 0.973 . . . . 0.0 112.829 -178.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 19.8 mt -71.71 -37.39 70.66 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 119.279 0.945 . . . . 0.0 110.687 169.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.8 172.81 12.88 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-O 122.043 0.925 . . . . 0.0 109.762 172.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.846 0 N-CA-C 107.809 -2.116 . . . . 0.0 107.809 171.903 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 40.2 tpp . . . . . 0 N--CA 1.469 0.508 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -121.76 -169.57 13.63 Favored Glycine 0 CA--C 1.523 0.537 0 C-N-CA 123.36 0.505 . . . . 0.0 113.248 -154.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -76.97 166.85 22.77 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 125.593 1.557 . . . . 0.0 110.704 176.059 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.67 -8.73 87.18 Favored Glycine 0 CA--C 1.531 1.04 0 O-C-N 121.816 -0.552 . . . . 0.0 113.641 -178.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 12.8 mp0 -90.6 10.24 26.41 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 118.289 1.044 . . . . 0.0 113.012 -170.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 14.2 p -126.85 159.87 62.0 Favored Pre-proline 0 C--O 1.239 0.519 0 CA-C-N 118.466 0.575 . . . . 0.0 109.499 -176.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -97.47 84.06 0.07 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.173 0 C-N-CA 122.61 2.207 . . . . 0.0 110.588 -177.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 75.4 143.66 0.1 OUTLIER Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 128.91 2.884 . . . . 0.0 110.455 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -84.11 -15.89 6.47 Favored 'Trans proline' 0 CA--C 1.535 0.548 0 C-N-CA 122.921 2.414 . . . . 0.0 112.21 175.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.434 HE22 ' CE1' ' A' ' 57' ' ' HIS . 0.0 OUTLIER -76.9 -13.52 59.98 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.736 0.814 . . . . 0.0 110.559 175.74 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 tt -68.43 130.97 44.46 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-N 118.385 0.539 . . . . 0.0 110.542 169.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 8.0 mm -119.08 102.55 13.16 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 126.602 1.961 . . . . 0.0 108.258 -179.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 84.5 m95 -58.84 148.83 67.42 Favored Pre-proline 0 CA--C 1.54 0.566 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 -175.327 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.99 172.45 56.93 Favored 'Cis proline' 0 N--CA 1.455 -0.776 0 N-CA-C 114.271 0.835 . . . . 0.0 114.271 5.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.17 166.11 25.96 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.306 172.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.9 mt -132.91 105.97 7.42 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 125.29 1.436 . . . . 0.0 107.333 -178.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 29.9 tp -66.9 142.03 57.44 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 171.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.14 94.53 2.54 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 107.47 -1.307 . . . . 0.0 107.47 165.365 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -59.32 155.9 13.7 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 126.013 1.725 . . . . 0.0 110.145 -173.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -63.79 116.47 5.78 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 127.453 2.301 . . . . 0.0 109.726 -173.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 79.9 -11.22 35.79 Favored Glycine 0 CA--C 1.528 0.898 0 CA-C-O 118.523 -1.154 . . . . 0.0 113.516 178.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 50.7 m -72.05 178.14 3.96 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.644 1.722 . . . . 0.0 109.688 167.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -142.47 -22.13 0.67 Allowed 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 125.166 1.386 . . . . 0.0 111.704 -178.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.49 148.14 49.92 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 166.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -104.96 150.09 25.2 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 170.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -106.75 88.54 3.58 Favored Pre-proline 0 C--O 1.234 0.254 0 C-N-CA 126.923 2.089 . . . . 0.0 110.883 175.372 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -56.82 131.32 44.85 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.579 2.186 . . . . 0.0 110.337 177.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -123.55 97.63 5.47 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 125.91 1.684 . . . . 0.0 107.477 172.09 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.5 mtt85 -56.18 -45.54 79.71 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 118.584 0.629 . . . . 0.0 110.939 177.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 12.3 t -148.82 -175.6 5.01 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 121.737 0.779 . . . . 0.0 110.054 173.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -54.12 -34.58 60.66 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.176 1.39 . . . . 0.0 111.61 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -61.22 -41.23 96.48 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.216 0.532 . . . . 0.0 109.878 178.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -70.49 -27.87 64.54 Favored 'General case' 0 C--O 1.232 0.141 0 C-N-CA 125.471 1.508 . . . . 0.0 110.639 -177.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 42.5 t-105 -68.08 -50.97 51.67 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.989 0.916 . . . . 0.0 110.242 166.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -58.76 -38.9 79.48 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 118.723 0.692 . . . . 0.0 110.115 -177.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 63.6 mtt180 -59.55 -13.42 9.14 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 177.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -77.68 -66.98 0.77 Allowed 'General case' 0 CA--C 1.528 0.116 0 CA-C-N 120.844 1.657 . . . . 0.0 108.841 167.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 16.8 p -69.0 -13.69 62.61 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 114.467 1.284 . . . . 0.0 114.467 -172.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -82.58 -21.92 35.05 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 125.581 1.552 . . . . 0.0 112.63 172.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -149.22 2.1 0.56 Allowed 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 115.357 1.614 . . . . 0.0 115.357 -156.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 44.6 t -149.77 -65.68 0.21 Allowed 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 -174.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 33.8 pttt 56.1 23.26 6.71 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 117.569 2.433 . . . . 0.0 117.569 159.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -117.02 11.9 14.41 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 115.15 1.537 . . . . 0.0 115.15 -166.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 12.8 mt -152.61 79.12 1.21 Allowed 'General case' 0 N--CA 1.432 -1.332 0 CA-C-N 115.058 -0.973 . . . . 0.0 108.934 -159.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 92.8 mt -149.31 101.83 3.16 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 -175.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -122.07 156.39 33.67 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.752 1.221 . . . . 0.0 109.265 -167.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.469 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 14.8 m-85 -68.59 96.18 0.69 Allowed 'General case' 0 C--O 1.233 0.236 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 174.298 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 131.31 7.61 3.13 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 124.153 0.883 . . . . 0.0 113.516 -176.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.43 -20.56 55.98 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 116.142 1.905 . . . . 0.0 116.142 -168.39 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt 44.59 128.54 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 130.784 3.634 . . . . 0.0 118.572 171.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 5.3 mt -127.86 151.98 48.39 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 124.605 1.162 . . . . 0.0 109.079 178.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 81.6 t -127.03 142.11 44.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 N-CA-C 104.959 -2.237 . . . . 0.0 104.959 163.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 14.3 p-10 -107.56 176.51 5.13 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 124.736 1.214 . . . . 0.0 110.872 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.23 -11.31 30.01 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.103 0.961 . . . . 0.0 112.846 -179.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -99.83 6.05 45.4 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.475 1.51 . . . . 0.0 110.37 179.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 66.25 18.32 10.9 Favored 'General case' 0 C--N 1.344 0.36 0 C-N-CA 127.158 2.183 . . . . 0.0 112.075 -178.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.434 ' CE1' HE22 ' A' ' 10' ' ' GLN . 22.5 m170 -75.31 117.28 16.95 Favored 'General case' 0 N--CA 1.443 -0.803 0 O-C-N 120.99 -1.069 . . . . 0.0 108.892 175.525 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 57.1 m -75.49 138.02 41.3 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 169.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -143.5 158.0 44.0 Favored 'General case' 0 C--N 1.334 -0.105 0 C-N-CA 126.244 1.817 . . . . 0.0 111.071 177.442 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.412 ' HA ' ' CZ3' ' A' ' 67' ' ' TRP . 4.1 p -152.45 151.21 12.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 168.097 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 34.3 tp -69.38 132.7 46.8 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 127.176 2.19 . . . . 0.0 109.41 173.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -113.51 174.98 5.65 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.973 1.309 . . . . 0.0 109.399 178.053 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.469 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 28.4 mt-10 -64.31 -20.49 66.12 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 125.715 1.606 . . . . 0.0 113.146 -177.386 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -82.0 6.08 17.23 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.416 1.487 . . . . 0.0 111.612 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 68.03 -4.52 1.01 Allowed 'General case' 0 C--O 1.237 0.404 0 C-N-CA 128.874 2.87 . . . . 0.0 113.931 -175.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -77.49 168.3 20.23 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 119.378 0.99 . . . . 0.0 111.959 172.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.412 ' CZ3' ' HA ' ' A' ' 60' ' ' VAL . 22.2 m95 -107.99 144.02 35.86 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 107.407 -1.331 . . . . 0.0 107.407 166.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -134.22 151.73 76.96 Favored Pre-proline 0 C--N 1.331 -0.235 0 C-N-CA 124.557 1.143 . . . . 0.0 111.626 -167.729 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -74.71 146.95 34.62 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 124.026 3.151 . . . . 0.0 112.607 -172.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -135.07 36.49 3.03 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.205 1.402 . . . . 0.0 111.927 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 70.99 166.4 0.13 Allowed Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 126.519 1.928 . . . . 0.0 111.896 -177.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.02 176.38 9.99 Favored 'Trans proline' 0 CA--C 1.535 0.543 0 C-N-CA 121.386 1.39 . . . . 0.0 111.269 170.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 14.5 tp -120.77 151.35 54.41 Favored Pre-proline 0 CA--C 1.543 0.675 0 C-N-CA 125.17 1.388 . . . . 0.0 110.234 -176.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -73.27 163.16 38.66 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.837 2.358 . . . . 0.0 111.171 168.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.0 -25.17 23.17 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 122.423 2.082 . . . . 0.0 112.879 179.104 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -83.36 -19.03 36.86 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 119.132 0.878 . . . . 0.0 110.636 176.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.69 -18.2 51.7 Favored Glycine 0 CA--C 1.532 1.111 0 N-CA-C 111.269 -0.733 . . . . 0.0 111.269 171.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 40.3 tp -60.0 -54.06 50.47 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 124.836 1.254 . . . . 0.0 108.429 170.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . 0.442 HD21 ' CG ' ' A' ' 98' ' ' HIS . 5.9 m120 -62.73 -24.64 67.78 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 125.501 1.521 . . . . 0.0 112.239 179.556 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 -66.91 -45.4 78.06 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 120.393 1.451 . . . . 0.0 109.874 172.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -67.62 -54.98 15.18 Favored 'General case' 0 C--O 1.231 0.111 0 N-CA-C 108.218 -1.031 . . . . 0.0 108.218 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 12.2 mm -55.7 -32.22 30.95 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 125.165 1.386 . . . . 0.0 110.961 -178.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.81 -57.04 4.63 Favored 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 124.259 1.023 . . . . 0.0 111.447 175.325 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -70.5 -34.87 72.82 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 120.341 -0.543 . . . . 0.0 111.58 -170.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 28.5 t60 -60.67 -53.16 60.85 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.661 0.784 . . . . 0.0 109.852 175.442 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 99.6 m -63.8 -37.91 89.15 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 118.296 -0.859 . . . . 0.0 110.484 179.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.06 -36.49 77.73 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 119.242 0.928 . . . . 0.0 112.402 -179.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 13.1 t -70.06 -32.82 71.11 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.886 0.766 . . . . 0.0 110.479 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 63.8 mt -80.03 -56.59 4.14 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.721 0.808 . . . . 0.0 109.682 177.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 135.19 7.83 1.91 Allowed Glycine 0 CA--C 1.539 1.548 0 C-N-CA 126.004 1.764 . . . . 0.0 114.055 -175.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 39.3 m-70 -87.01 170.49 11.52 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 119.956 1.878 . . . . 0.0 110.488 -179.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 5.6 m -140.81 -27.75 0.71 Allowed 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 116.153 1.908 . . . . 0.0 116.153 175.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -178.58 175.21 1.13 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.304 1.441 . . . . 0.0 111.162 -173.915 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . 0.27 12.3 t -142.68 -74.56 0.28 Allowed 'General case' 0 N--CA 1.445 -0.697 0 C-N-CA 125.904 1.682 . . . . 0.0 107.385 179.041 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 2.5 p -158.04 -178.48 7.33 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.827 1.251 . . . . 0.0 110.207 -178.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.468 ' HE2' ' HB2' ' A' ' 100' ' ' HIS . 43.9 tttt 66.12 17.45 10.76 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 114.377 1.251 . . . . 0.0 114.377 156.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 9.7 tmm? 53.4 87.18 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.428 1.891 . . . . 0.0 107.988 -157.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . 0.442 ' CG ' HD21 ' A' ' 79' ' ' ASN . 58.8 m80 48.32 -86.16 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 127.383 2.273 . . . . 0.0 112.84 -174.293 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 43.1 mt -148.07 128.89 14.31 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 127.567 2.347 . . . . 0.0 106.309 -160.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . 0.468 ' HB2' ' HE2' ' A' ' 96' ' ' LYS . 2.1 t-80 -66.57 -46.24 76.68 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.924 0.393 . . . . 0.0 110.331 -176.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 74.3 m -153.72 174.04 15.05 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.264 1.426 . . . . 0.0 110.292 -171.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 38.8 t -50.41 -39.74 17.52 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 C-N-CA 126.799 2.04 . . . . 0.0 109.496 173.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 20.9 tpp -57.1 -40.03 76.22 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 124.186 0.994 . . . . 0.0 113.386 177.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -69.89 -42.1 73.86 Favored 'General case' 0 N--CA 1.463 0.177 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 177.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.74 -45.6 91.97 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.785 1.234 . . . . 0.0 112.381 -172.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 11.0 mm -58.05 -43.9 86.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -66.85 -46.43 75.1 Favored 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 124.154 0.981 . . . . 0.0 110.411 -178.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 36.1 t80 -53.71 -61.48 2.27 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 125.516 1.526 . . . . 0.0 110.063 177.391 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 7.2 mp -50.34 -46.76 55.92 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.154 1.382 . . . . 0.0 112.384 175.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -63.0 -36.77 84.66 Favored 'General case' 0 C--N 1.333 -0.142 0 O-C-N 123.323 0.39 . . . . 0.0 111.591 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -74.86 -26.13 59.46 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 118.542 -0.742 . . . . 0.0 111.584 179.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 29.2 mt -63.96 -60.78 2.83 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 124.043 0.937 . . . . 0.0 109.358 -177.331 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 49.37 21.29 0.54 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 127.904 2.481 . . . . 0.0 116.709 176.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.661 -1.077 . . . . 0.0 111.625 168.96 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.517 -0.304 0 N-CA-C 106.046 -1.835 . . . . 0.0 106.046 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 134.0 82.1 0.18 Allowed Glycine 0 CA--C 1.521 0.448 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -164.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 45.52 -154.94 0.04 OUTLIER 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.622 1.969 . . . . 0.0 115.11 170.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -175.61 -101.94 0.15 Allowed Glycine 0 C--N 1.333 0.39 0 N-CA-C 106.788 -2.525 . . . . 0.0 106.788 175.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -84.63 15.76 3.62 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.64 1.176 . . . . 0.0 111.711 -178.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -113.9 157.28 42.34 Favored Pre-proline 0 N--CA 1.446 -0.627 0 C-N-CA 127.708 2.403 . . . . 0.0 109.924 -176.488 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.24 -55.04 0.07 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.207 0 C-N-CA 121.756 1.637 . . . . 0.0 110.883 177.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 19.0 t-80 -150.56 147.41 21.36 Favored Pre-proline 0 CA--C 1.534 0.338 0 C-N-CA 125.732 1.613 . . . . 0.0 107.708 -178.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -69.11 -38.62 8.94 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 122.795 2.33 . . . . 0.0 111.885 176.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.29 -17.58 61.86 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 117.901 -1.047 . . . . 0.0 112.255 -176.167 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.9 tt -58.74 122.6 13.93 Favored 'General case' 0 C--N 1.346 0.425 0 CA-C-N 118.692 0.678 . . . . 0.0 109.315 170.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.402 ' CG1' HD22 ' A' ' 55' ' ' ASN . 43.6 mm -109.95 117.43 54.66 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.257 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 176.28 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -55.17 152.51 14.88 Favored Pre-proline 0 CA--C 1.534 0.335 0 C-N-CA 123.841 0.856 . . . . 0.0 111.114 174.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -73.38 174.27 51.24 Favored 'Cis proline' 0 CA--C 1.535 0.541 0 C-N-CA 125.204 -0.749 . . . . 0.0 112.792 -0.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -138.55 173.06 11.99 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 121.234 0.54 . . . . 0.0 111.887 177.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 18.8 mt -139.78 110.38 6.71 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 126.014 1.725 . . . . 0.0 109.301 -175.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.8 tp -87.2 150.81 23.68 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.365 1.066 . . . . 0.0 108.303 167.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.13 84.84 2.06 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 119.895 1.225 . . . . 0.0 108.621 170.241 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.458 ' NE2' HE21 ' A' ' 46' ' ' GLN . 0.1 OUTLIER -52.41 134.15 34.63 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 122.815 0.446 . . . . 0.0 111.273 -168.84 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -64.27 125.94 26.18 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.13 -0.941 . . . . 0.0 108.909 -168.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 98.29 -19.99 52.29 Favored Glycine 0 CA--C 1.527 0.815 0 CA-C-O 118.241 -1.311 . . . . 0.0 112.168 -178.405 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 2.3 t -88.85 -177.09 5.42 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 119.423 1.612 . . . . 0.0 109.989 174.263 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.1 m-80 -127.66 -12.66 5.44 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 124.644 1.178 . . . . 0.0 110.105 170.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -76.13 126.73 31.53 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 -176.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -75.51 147.32 39.85 Favored 'General case' 0 CA--C 1.52 -0.207 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 168.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -108.6 87.26 4.17 Favored Pre-proline 0 CA--C 1.537 0.453 0 C-N-CA 126.309 1.844 . . . . 0.0 109.081 175.057 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -66.32 113.09 2.53 Favored 'Trans proline' 0 N--CA 1.46 -0.496 0 C-N-CA 123.499 2.799 . . . . 0.0 109.901 177.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.2 mt -112.18 107.84 16.87 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 -177.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -51.65 -47.77 63.62 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 126.478 1.911 . . . . 0.0 111.587 -176.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.3 t -163.91 -179.25 6.16 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-O 121.949 0.88 . . . . 0.0 108.721 -168.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -68.33 -21.94 64.72 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 115.106 -0.952 . . . . 0.0 112.387 -175.384 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -69.85 -35.39 74.69 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 123.631 0.772 . . . . 0.0 110.626 169.224 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.8 t0 -67.03 -41.32 86.81 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 123.661 0.784 . . . . 0.0 109.423 177.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 75.5 t-105 -54.01 -41.06 67.57 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 121.536 -0.727 . . . . 0.0 111.193 172.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -71.91 -37.13 70.13 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 118.466 -0.778 . . . . 0.0 111.574 176.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.03 -50.29 74.65 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 119.485 1.039 . . . . 0.0 109.972 172.483 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -51.7 -57.03 10.37 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 119.289 0.95 . . . . 0.0 111.265 -173.21 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 25.7 p -67.24 -22.31 65.7 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.605 -0.725 . . . . 0.0 112.015 -175.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -77.81 -48.61 16.12 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.292 1.037 . . . . 0.0 112.832 171.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -102.01 -16.67 16.39 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.217 1.192 . . . . 0.0 114.217 -153.363 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 64.0 p -139.64 -32.3 0.64 Allowed 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 125.882 1.673 . . . . 0.0 111.291 -178.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.9 ttmt 70.29 -50.59 0.65 Allowed 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 129.799 3.24 . . . . 0.0 114.071 174.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER 45.13 21.68 0.06 Allowed 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 127.706 2.402 . . . . 0.0 115.309 172.265 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.5 mp 50.45 -177.09 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 127.182 2.193 . . . . 0.0 112.822 -172.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.1 mt -141.3 131.85 25.45 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 165.256 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.458 HE21 ' NE2' ' A' ' 19' ' ' GLN . 21.8 pt20 -140.33 163.06 33.79 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.315 1.046 . . . . 0.0 110.987 -174.759 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -76.19 70.92 2.88 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.622 1.169 . . . . 0.0 110.959 -171.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 152.03 18.18 0.06 OUTLIER Glycine 0 CA--C 1.524 0.6 0 CA-C-O 118.908 -0.94 . . . . 0.0 114.433 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -71.22 -17.04 62.53 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.305 1.442 . . . . 0.0 113.437 179.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 52.25 154.91 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 129.869 3.267 . . . . 0.0 113.454 -174.302 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.7 tp -136.73 151.62 49.43 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 106.156 -1.794 . . . . 0.0 106.156 169.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 39.8 t -134.46 141.03 44.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 105.359 -2.089 . . . . 0.0 105.359 163.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -106.15 -178.67 3.72 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.077 1.351 . . . . 0.0 111.422 176.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.3 t -58.75 -24.39 61.55 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.271 1.428 . . . . 0.0 112.62 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.402 HD22 ' CG1' ' A' ' 12' ' ' ILE . 47.5 m-80 -90.23 1.04 56.9 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 124.498 1.119 . . . . 0.0 111.618 -179.741 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 65.93 24.05 11.22 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.519 1.128 . . . . 0.0 111.254 -173.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 24.3 m170 -69.11 108.52 3.61 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 164.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 92.8 m -70.81 153.35 42.83 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 121.702 0.763 . . . . 0.0 109.055 164.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -142.86 156.33 44.91 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.334 1.454 . . . . 0.0 108.157 170.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 25.7 t -135.19 144.69 33.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 C-N-CA 125.667 1.587 . . . . 0.0 107.78 166.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 11.9 tp -75.29 129.76 37.95 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 128.859 2.864 . . . . 0.0 106.872 175.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -120.91 170.55 9.38 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -178.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -61.09 -23.52 65.55 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 123.762 0.825 . . . . 0.0 112.161 -175.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -74.97 4.14 7.11 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.613 1.565 . . . . 0.0 112.341 176.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 58.56 21.77 9.01 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 128.419 2.687 . . . . 0.0 113.517 175.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -101.65 170.54 8.11 Favored 'General case' 0 C--O 1.232 0.17 0 C-N-CA 123.971 0.908 . . . . 0.0 110.259 163.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 62.2 m95 -103.16 95.47 6.14 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 171.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 60.5 t60 -69.13 144.51 95.38 Favored Pre-proline 0 CA--C 1.54 0.572 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 178.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -69.82 106.48 1.68 Allowed 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 123.788 2.992 . . . . 0.0 111.386 178.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -81.51 37.28 0.45 Allowed 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.59 1.556 . . . . 0.0 111.895 -177.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 69.79 165.05 0.13 Allowed Pre-proline 0 CA--C 1.541 0.611 0 C-N-CA 128.364 2.666 . . . . 0.0 112.751 -173.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -74.44 168.23 25.3 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 121.336 1.357 . . . . 0.0 110.06 166.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 21.6 tp -121.33 144.3 39.6 Favored Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 124.622 1.169 . . . . 0.0 108.817 -176.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.89 167.48 27.11 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.708 2.272 . . . . 0.0 110.76 172.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -66.46 -35.09 31.78 Favored 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 120.791 0.994 . . . . 0.0 111.491 -175.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -67.48 -27.11 66.74 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.886 1.274 . . . . 0.0 110.731 174.119 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -69.49 -29.61 71.5 Favored Glycine 0 N--CA 1.444 -0.788 0 CA-C-O 119.351 -0.694 . . . . 0.0 111.655 -173.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 21.1 tp -51.52 -47.42 63.33 Favored 'General case' 0 C--N 1.342 0.251 0 CA-C-N 117.683 0.741 . . . . 0.0 110.158 170.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -58.62 -30.64 67.42 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-O 117.259 -1.353 . . . . 0.0 111.384 -173.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 60.8 m-20 -57.68 -37.06 72.8 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 120.302 1.41 . . . . 0.0 111.279 176.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -71.42 -62.14 1.52 Allowed 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 -178.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 15.9 mm -59.47 -28.12 38.99 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 122.991 0.517 . . . . 0.0 111.671 -174.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.5 mtm180 -48.65 -40.59 28.44 Favored 'General case' 0 C--N 1.338 0.096 0 C-N-CA 124.924 1.29 . . . . 0.0 111.619 171.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.48 -61.41 2.46 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.446 1.098 . . . . 0.0 110.441 177.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -52.32 -43.89 64.8 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 125.514 1.526 . . . . 0.0 110.015 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 93.8 m -68.48 -43.62 76.56 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 121.588 -0.695 . . . . 0.0 111.86 179.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.11 -39.18 92.74 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 118.812 0.733 . . . . 0.0 111.246 -174.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 12.4 t -69.33 -11.74 61.07 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 118.189 -0.91 . . . . 0.0 111.791 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 67.2 mt -125.78 -4.44 7.03 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.71 1.604 . . . . 0.0 113.231 -176.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 73.75 20.91 79.8 Favored Glycine 0 CA--C 1.536 1.402 0 O-C-N 120.403 -1.436 . . . . 0.0 114.501 -178.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 10.1 m-70 -63.83 161.65 15.02 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-N 119.951 1.876 . . . . 0.0 112.476 -172.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 84.4 m -81.07 -173.68 4.43 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.882 2.073 . . . . 0.0 112.921 177.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 5.4 t -152.78 139.37 18.74 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 127.196 2.199 . . . . 0.0 107.739 172.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 10.8 t -154.99 -164.55 1.82 Allowed 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.901 1.68 . . . . 0.0 109.102 -172.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 3.8 t 54.11 32.31 15.51 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 127.576 2.35 . . . . 0.0 116.911 154.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.48 ' HZ3' ' CE1' ' A' ' 100' ' ' HIS . 35.9 ttpt 68.45 113.51 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 126.247 1.819 . . . . 0.0 110.361 -174.588 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 10.9 ttp 52.47 44.35 30.05 Favored 'General case' 0 CA--C 1.52 -0.192 0 C-N-CA 125.597 1.559 . . . . 0.0 111.852 170.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 63.73 -85.28 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.656 1.582 . . . . 0.0 107.74 -176.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.442 ' H ' HD23 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -111.24 115.25 29.03 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 126.583 1.953 . . . . 0.0 109.388 172.514 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . 0.48 ' CE1' ' HZ3' ' A' ' 96' ' ' LYS . 10.7 t-160 -58.65 -28.99 66.21 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 172.314 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 18.6 m -148.86 165.15 32.37 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.458 -0.776 . . . . 0.0 110.229 -172.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 40.6 t -63.11 -35.72 72.94 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 O-C-N 121.65 -0.657 . . . . 0.0 109.873 179.314 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -40.65 88.54 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 126.495 1.918 . . . . 0.0 111.233 175.464 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.59 -51.02 71.19 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 178.655 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.12 -50.91 71.82 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.057 1.343 . . . . 0.0 112.794 -176.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 33.9 mm -55.87 -47.92 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 CA-C-N 119.938 1.245 . . . . 0.0 109.041 -175.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -69.66 -40.76 76.24 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 123.954 0.902 . . . . 0.0 110.105 -172.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -52.17 -67.08 0.28 Allowed 'General case' 0 C--O 1.224 -0.237 0 C-N-CA 125.224 1.41 . . . . 0.0 109.633 171.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 7.7 mp -45.45 -45.97 13.26 Favored 'General case' 0 C--N 1.345 0.383 0 C-N-CA 124.498 1.119 . . . . 0.0 112.08 175.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -62.64 -39.92 95.38 Favored 'General case' 0 C--N 1.334 -0.079 0 CA-C-O 119.207 -0.425 . . . . 0.0 112.031 -178.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -85.7 -11.25 54.18 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 118.531 0.605 . . . . 0.0 112.497 -176.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 45.4 mt -71.61 -38.09 70.85 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 118.932 0.787 . . . . 0.0 110.082 173.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -59.54 163.8 3.92 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.549 1.54 . . . . 0.0 109.766 173.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.664 0 CA-C-O 118.366 -1.241 . . . . 0.0 111.44 179.19 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.3 ttm . . . . . 0 N--CA 1.472 0.65 0 CA-C-O 117.413 -1.28 . . . . 0.0 111.793 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 155.12 81.78 0.03 OUTLIER Glycine 0 C--N 1.34 0.792 0 CA-C-N 120.689 1.586 . . . . 0.0 112.749 172.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 59.62 -168.8 0.15 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.421 1.488 . . . . 0.0 112.04 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 148.07 172.18 17.79 Favored Glycine 0 CA--C 1.528 0.852 0 C-N-CA 124.278 0.942 . . . . 0.0 111.632 177.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -83.06 16.67 2.25 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.441 -1.035 . . . . 0.0 111.589 -174.23 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.83 160.83 42.54 Favored Pre-proline 0 CA--C 1.542 0.651 0 C-N-CA 126.027 1.731 . . . . 0.0 111.558 176.403 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -83.6 80.3 2.54 Favored 'Trans proline' 0 N--CA 1.448 -1.179 0 C-N-CA 122.837 2.358 . . . . 0.0 109.204 -175.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 75.33 149.69 0.13 Allowed Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 127.12 2.168 . . . . 0.0 110.917 -176.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -93.26 -18.77 0.56 Allowed 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 122.751 2.3 . . . . 0.0 112.572 174.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.83 -18.58 65.45 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 119.162 0.892 . . . . 0.0 110.37 169.725 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 tt -67.58 132.01 46.73 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.321 0.648 . . . . 0.0 110.683 169.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 40.1 mm -120.87 99.97 8.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 C-N-CA 126.822 2.049 . . . . 0.0 108.398 -174.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -50.06 151.16 3.63 Favored Pre-proline 0 C--O 1.235 0.335 0 C-N-CA 124.059 0.944 . . . . 0.0 112.621 179.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -70.48 165.49 78.56 Favored 'Cis proline' 0 CA--C 1.532 0.387 0 O-C-N 122.982 0.99 . . . . 0.0 112.754 1.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -140.11 172.11 13.23 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.328 0.585 . . . . 0.0 111.809 176.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 14.7 mt -140.36 105.83 5.08 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 127.072 2.149 . . . . 0.0 107.498 -171.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 25.9 tp -77.72 152.85 33.47 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 167.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.19 84.75 1.71 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.959 1.254 . . . . 0.0 113.426 176.343 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -44.89 144.59 1.14 Allowed 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 116.012 1.856 . . . . 0.0 116.012 -166.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -76.67 85.63 3.32 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 124.981 1.312 . . . . 0.0 109.681 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 138.21 -34.85 2.09 Favored Glycine 0 CA--C 1.524 0.643 0 C-N-CA 126.426 1.965 . . . . 0.0 110.988 175.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -83.38 -20.68 33.78 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 118.371 -0.823 . . . . 0.0 113.092 -163.187 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 12.8 m-80 71.64 -21.43 0.21 Allowed 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 126.811 2.044 . . . . 0.0 112.511 -179.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -65.47 150.38 48.45 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 125.791 1.636 . . . . 0.0 111.56 173.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.2 mt -107.22 153.47 22.64 Favored 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 126.141 1.776 . . . . 0.0 109.013 171.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -118.57 86.87 30.07 Favored Pre-proline 0 CA--C 1.537 0.447 0 C-N-CA 124.992 1.317 . . . . 0.0 109.557 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -65.08 128.18 20.06 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 123.483 2.788 . . . . 0.0 110.338 178.126 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.2 mt -134.36 113.93 12.42 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 -177.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 4.1 mtt85 -64.64 -46.71 81.38 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.849 0.86 . . . . 0.0 112.419 -169.351 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.537 ' H ' ' HB2' ' A' ' 33' ' ' ASP . 43.1 p -141.48 -179.92 6.43 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.931 1.293 . . . . 0.0 109.738 -178.432 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -53.62 -36.36 61.92 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 123.705 0.802 . . . . 0.0 110.752 167.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -65.98 -30.22 70.74 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 123.241 0.616 . . . . 0.0 110.84 -179.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.537 ' HB2' ' H ' ' A' ' 30' ' ' THR . 0.3 OUTLIER -70.79 -41.22 71.93 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 123.621 0.769 . . . . 0.0 109.892 174.961 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 67.6 t-105 -60.72 -42.82 98.03 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 110.5 -0.185 . . . . 0.0 110.5 173.44 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -59.42 -38.37 80.47 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 121.175 -0.953 . . . . 0.0 110.982 174.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.62 -18.3 63.77 Favored 'General case' 0 C--O 1.227 -0.098 0 C-N-CA 125.599 1.56 . . . . 0.0 112.826 176.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -73.33 -66.49 0.68 Allowed 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 178.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 11.4 p -60.89 -28.15 68.69 Favored 'General case' 0 C--O 1.234 0.267 0 O-C-N 121.157 -0.965 . . . . 0.0 112.885 -178.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -78.35 -11.55 59.95 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 117.698 -1.144 . . . . 0.0 112.273 177.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -143.33 84.34 1.81 Allowed 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 119.822 1.192 . . . . 0.0 110.027 -174.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 75.31 110.43 0.07 Allowed 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 128.14 2.576 . . . . 0.0 109.719 -171.16 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.8 mttt -75.87 65.52 1.98 Allowed 'General case' 0 C--O 1.235 0.339 0 O-C-N 120.762 -1.211 . . . . 0.0 108.457 174.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.4 t-160 -48.44 134.65 15.01 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 124.493 1.117 . . . . 0.0 108.253 175.088 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.5 mp -49.64 147.96 3.23 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 123.463 0.705 . . . . 0.0 110.269 175.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 19.9 mt -133.1 126.47 31.84 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 177.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -108.85 149.1 29.6 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 126.482 1.913 . . . . 0.0 108.048 -179.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.44 ' CD1' HD11 ' A' ' 61' ' ' LEU . 57.9 m-85 -71.73 153.51 41.96 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 176.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.15 16.95 73.48 Favored Glycine 0 CA--C 1.531 1.067 0 CA-C-O 119.509 -0.606 . . . . 0.0 114.087 -173.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -59.65 -25.46 64.72 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.09 1.445 . . . . 0.0 113.283 175.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.7 ttmt 69.75 142.29 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 127.759 2.423 . . . . 0.0 111.006 -175.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.68 146.81 47.96 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 105.497 -2.038 . . . . 0.0 105.497 165.348 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 72.5 t -135.28 143.71 36.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 106.343 -1.725 . . . . 0.0 106.343 170.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -125.3 -179.13 4.46 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.03 1.732 . . . . 0.0 111.627 -177.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.41 -19.49 65.96 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.977 1.102 . . . . 0.0 113.977 179.109 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -85.69 0.18 53.45 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 118.869 0.759 . . . . 0.0 111.065 175.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 54.78 31.7 16.07 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 126.16 1.784 . . . . 0.0 110.107 -168.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 29.6 m170 -71.23 115.21 10.11 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 120.248 -1.533 . . . . 0.0 107.151 166.276 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.2 m -77.03 147.51 36.72 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 167.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -135.92 159.7 40.87 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 125.014 1.325 . . . . 0.0 108.125 169.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 27.2 t -137.84 135.13 45.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 C-N-CA 129.061 2.944 . . . . 0.0 106.333 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.44 HD11 ' CD1' ' A' ' 47' ' ' TYR . 0.4 OUTLIER -78.27 140.02 38.87 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 175.127 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -113.49 161.16 17.69 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 123.259 0.624 . . . . 0.0 109.824 175.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -53.15 -25.61 14.03 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.655 0.782 . . . . 0.0 112.528 -177.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.83 -12.15 2.87 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 129.404 3.082 . . . . 0.0 114.041 172.192 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 63.69 36.73 10.55 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-N 120.423 1.465 . . . . 0.0 110.851 -174.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -124.3 173.57 8.29 Favored 'General case' 0 N--CA 1.457 -0.099 0 C-N-CA 125.072 1.349 . . . . 0.0 111.161 164.375 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 70.7 m95 -115.89 121.28 41.86 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 125.074 1.35 . . . . 0.0 107.87 177.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -95.34 155.79 38.39 Favored Pre-proline 0 N--CA 1.439 -0.981 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 179.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -66.53 121.36 8.6 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 123.084 2.523 . . . . 0.0 109.094 170.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -108.23 40.53 1.74 Allowed 'General case' 0 C--O 1.236 0.35 0 C-N-CA 124.747 1.219 . . . . 0.0 109.987 -177.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.85 165.91 0.13 Allowed Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 127.136 2.174 . . . . 0.0 112.682 179.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -71.79 178.0 6.3 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 121.567 1.511 . . . . 0.0 111.007 166.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 15.7 tp -142.65 145.06 32.6 Favored Pre-proline 0 CA--C 1.535 0.369 0 C-N-CA 124.083 0.953 . . . . 0.0 111.648 -169.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -67.81 165.88 26.29 Favored 'Trans proline' 0 CA--C 1.536 0.617 0 C-N-CA 122.619 2.213 . . . . 0.0 113.039 176.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -61.77 -22.5 74.51 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 123.688 2.925 . . . . 0.0 113.257 173.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -86.36 -16.37 37.59 Favored 'General case' 0 C--N 1.332 -0.179 0 O-C-N 121.304 -0.872 . . . . 0.0 112.25 176.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -67.55 -32.89 79.78 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 120.537 -0.839 . . . . 0.0 111.958 179.326 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 35.8 tp -53.97 -58.62 6.63 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 118.054 0.927 . . . . 0.0 108.581 168.227 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -46.14 -37.69 7.27 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 126.52 1.928 . . . . 0.0 113.502 178.717 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -70.86 -37.21 73.08 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 124.583 1.153 . . . . 0.0 112.005 -177.518 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.2 tp -70.37 -51.45 29.72 Favored 'General case' 0 CA--C 1.521 -0.15 0 C-N-CA 124.866 1.266 . . . . 0.0 110.964 175.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 27.6 mm -57.47 -35.54 50.07 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 -177.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -46.22 -39.22 9.48 Favored 'General case' 0 C--O 1.224 -0.253 0 C-N-CA 124.798 1.239 . . . . 0.0 112.988 173.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.97 -62.27 1.98 Allowed 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 123.718 0.807 . . . . 0.0 109.599 178.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 42.8 t60 -57.7 -39.14 76.52 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.151 0.98 . . . . 0.0 110.723 -177.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 66.0 m -64.88 -41.12 95.89 Favored 'General case' 0 N--CA 1.448 -0.527 0 O-C-N 121.438 -0.789 . . . . 0.0 111.788 176.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.33 -38.27 81.37 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 124.493 1.117 . . . . 0.0 112.302 179.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.2 t -64.44 -40.56 95.98 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 118.895 0.77 . . . . 0.0 109.809 178.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 85.2 mt -82.11 -72.35 0.44 Allowed 'General case' 0 C--O 1.233 0.227 0 C-N-CA 123.819 0.848 . . . . 0.0 108.789 -176.108 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 143.61 42.19 0.06 OUTLIER Glycine 0 CA--C 1.525 0.7 0 C-N-CA 124.761 1.172 . . . . 0.0 111.212 -177.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 70.8 m-70 -124.52 177.57 5.86 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 124.136 0.974 . . . . 0.0 111.347 -174.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 28.5 t -145.34 -55.71 0.31 Allowed 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 123.162 1.458 . . . . 0.0 110.191 166.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 7.9 p -146.94 -177.15 5.5 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.931 -172.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 2.4 t -150.6 -42.07 0.13 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-O 118.684 -0.674 . . . . 0.0 109.416 177.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 9.2 t -131.97 -52.4 0.98 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-N 118.987 0.812 . . . . 0.0 112.423 -168.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 17.3 ptmt -147.39 97.34 2.84 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 119.684 1.129 . . . . 0.0 110.987 -174.111 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.439 ' CG ' ' H ' ' A' ' 98' ' ' HIS . 5.3 tmm? 51.0 -157.75 0.1 Allowed 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 -171.409 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . 0.439 ' H ' ' CG ' ' A' ' 97' ' ' MET . 0.0 OUTLIER -53.08 -67.1 0.28 Allowed 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 171.706 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 97.1 mt -149.41 153.25 37.07 Favored 'General case' 0 CA--C 1.511 -0.522 0 C-N-CA 126.476 1.91 . . . . 0.0 109.279 -174.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 26.2 t-80 -76.32 -47.09 24.77 Favored 'General case' 0 N--CA 1.444 -0.728 0 C-N-CA 124.407 1.083 . . . . 0.0 112.018 167.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 53.9 m -170.14 179.11 3.62 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 125.461 1.504 . . . . 0.0 111.154 -171.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 63.8 t -66.47 -42.97 91.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 CA-C-N 119.602 1.092 . . . . 0.0 111.089 -174.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 4.4 tpt -56.83 -46.77 81.48 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 118.714 0.688 . . . . 0.0 109.405 -179.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -58.53 -36.84 74.48 Favored 'General case' 0 C--N 1.339 0.147 0 C-N-CA 124.143 0.977 . . . . 0.0 110.194 177.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.62 -45.73 85.63 Favored 'General case' 0 C--O 1.227 -0.131 0 C-N-CA 123.418 0.687 . . . . 0.0 111.929 178.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 30.1 mm -59.03 -47.78 88.82 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 -177.019 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -75.82 -32.04 59.65 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 118.834 -0.603 . . . . 0.0 111.31 -177.328 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -60.18 -56.4 22.02 Favored 'General case' 0 C--N 1.342 0.25 0 C-N-CA 123.922 0.889 . . . . 0.0 110.202 173.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 25.3 mt -57.6 -43.25 84.55 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -175.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -68.86 -7.69 36.87 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 175.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -107.03 -7.95 16.74 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 119.817 1.19 . . . . 0.0 112.601 176.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . 0.293 1.3 tp -98.13 -46.56 5.81 Favored 'General case' 0 N--CA 1.416 -2.151 0 C-N-CA 126.472 1.909 . . . . 0.0 109.063 -177.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.44 158.7 5.45 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 124.747 1.219 . . . . 0.0 113.805 -156.456 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.242 0 CA-C-O 118.016 -1.435 . . . . 0.0 110.453 171.702 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 42.0 mmm . . . . . 0 N--CA 1.472 0.63 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 133.44 88.48 0.35 Allowed Glycine 0 C--N 1.338 0.671 0 N-CA-C 110.914 -0.875 . . . . 0.0 110.914 172.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -98.44 97.72 9.02 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.758 0.823 . . . . 0.0 110.142 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -172.88 -27.17 0.02 OUTLIER Glycine 0 CA--C 1.525 0.715 0 CA-C-O 119.516 -0.602 . . . . 0.0 113.346 171.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -117.49 15.32 14.67 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 125.338 1.455 . . . . 0.0 110.111 177.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 6.8 p -130.55 153.68 81.5 Favored Pre-proline 0 C--O 1.239 0.518 0 C-N-CA 125.517 1.527 . . . . 0.0 110.572 -162.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -68.18 -55.37 0.25 Allowed 'Trans proline' 0 N--CA 1.45 -1.081 0 C-N-CA 121.699 1.599 . . . . 0.0 110.842 169.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -140.45 153.88 68.91 Favored Pre-proline 0 CA--C 1.542 0.65 0 C-N-CA 126.949 2.1 . . . . 0.0 108.481 177.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -85.25 -17.94 4.32 Favored 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 122.75 2.3 . . . . 0.0 113.513 173.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -78.82 -17.61 55.41 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 118.905 0.775 . . . . 0.0 112.278 -179.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.99 135.22 53.42 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.455 0.702 . . . . 0.0 111.013 165.224 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.428 ' CG1' HD22 ' A' ' 55' ' ' ASN . 47.9 mm -123.07 108.02 20.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 C-N-CA 127.27 2.228 . . . . 0.0 106.892 176.483 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 56.6 m95 -52.6 151.99 7.19 Favored Pre-proline 0 C--O 1.238 0.473 0 C-N-CA 124.68 1.192 . . . . 0.0 111.644 -179.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -69.69 169.44 63.06 Favored 'Cis proline' 0 N--CA 1.457 -0.658 0 N-CA-C 115.411 1.274 . . . . 0.0 115.411 -0.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.78 171.23 14.71 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.596 1.159 . . . . 0.0 111.392 -175.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -146.53 102.78 3.61 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.514 1.125 . . . . 0.0 111.04 -165.303 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.9 tp -78.32 150.32 33.3 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 123.35 0.66 . . . . 0.0 109.23 177.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.7 84.98 1.36 Allowed 'General case' 0 C--O 1.237 0.416 0 CA-C-N 119.082 0.855 . . . . 0.0 110.574 174.404 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -59.76 158.59 10.11 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 123.565 0.746 . . . . 0.0 110.762 -167.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -67.22 125.33 25.72 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 122.836 1.303 . . . . 0.0 111.135 178.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 85.75 -31.96 3.82 Favored Glycine 0 CA--C 1.528 0.871 0 C-N-CA 125.692 1.615 . . . . 0.0 111.904 178.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 39.4 m -68.14 169.19 10.7 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 118.448 1.124 . . . . 0.0 110.077 170.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -141.1 -16.4 0.85 Allowed 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 125.265 1.426 . . . . 0.0 111.958 -175.021 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -71.03 105.94 3.51 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 175.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.452 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 3.9 mm? -60.37 137.86 58.07 Favored 'General case' 0 N--CA 1.462 0.162 0 N-CA-C 106.903 -1.518 . . . . 0.0 106.903 171.498 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.56 88.12 8.9 Favored Pre-proline 0 C--N 1.33 -0.261 0 C-N-CA 125.308 1.443 . . . . 0.0 107.864 -174.648 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -62.54 132.06 36.39 Favored 'Trans proline' 0 CA--C 1.541 0.829 0 C-N-CA 123.208 2.605 . . . . 0.0 109.994 176.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -119.4 118.05 30.13 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 106.105 -1.813 . . . . 0.0 106.105 168.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 72.7 mtm180 -75.03 -47.02 31.11 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 -174.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 67.4 p -135.59 178.59 6.92 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.815 0.846 . . . . 0.0 110.903 -179.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -60.03 -39.5 86.12 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.452 -0.78 . . . . 0.0 109.582 175.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -56.66 -23.81 44.17 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.459 1.104 . . . . 0.0 111.371 176.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -93.86 -32.51 13.9 Favored 'General case' 0 N--CA 1.454 -0.272 0 O-C-N 120.756 -1.215 . . . . 0.0 111.058 -172.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 11.0 t-105 -58.06 -42.83 86.3 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 165.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -53.53 -60.29 3.5 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 172.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.42 -25.78 62.48 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 117.556 -1.658 . . . . 0.0 110.204 -163.546 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 31.2 t80 -53.63 -51.01 64.45 Favored 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 123.23 0.612 . . . . 0.0 110.022 175.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 31.6 p -93.71 -5.63 48.05 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -174.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.51 -5.18 31.25 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 127.832 2.453 . . . . 0.0 112.488 163.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -145.49 116.1 7.66 Favored 'General case' 0 N--CA 1.436 -1.163 0 N-CA-C 104.484 -2.414 . . . . 0.0 104.484 -165.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.0 t -49.06 95.18 0.01 OUTLIER 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 126.611 1.964 . . . . 0.0 109.956 178.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.2 mmtp -132.04 -76.77 0.51 Allowed 'General case' 0 CA--C 1.518 -0.255 0 C-N-CA 125.38 1.472 . . . . 0.0 107.702 -173.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -138.09 160.08 40.33 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 -172.462 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.444 HD23 ' H ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -111.18 122.37 47.71 Favored 'General case' 0 CA--C 1.513 -0.451 0 C-N-CA 125.146 1.378 . . . . 0.0 108.985 -160.723 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 48.5 mt -75.48 128.54 35.55 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -142.78 163.61 32.34 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 125.941 1.696 . . . . 0.0 107.54 -178.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.458 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 20.6 m-85 -55.95 138.23 49.2 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.77 0.795 . . . . 0.0 110.67 -179.108 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.28 7.69 76.15 Favored Glycine 0 CA--C 1.536 1.384 0 CA-C-O 118.096 -1.391 . . . . 0.0 114.244 179.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.97 -27.17 61.02 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 119.716 1.758 . . . . 0.0 115.483 -170.487 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 22.0 ttmt 57.62 152.2 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 130.38 3.472 . . . . 0.0 115.791 174.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.4 tp -141.19 155.58 46.04 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 174.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 97.0 t -130.58 155.43 41.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 105.105 -2.183 . . . . 0.0 105.105 157.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -123.5 -179.74 4.45 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 126.521 1.928 . . . . 0.0 111.76 176.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.5 m -68.55 -17.12 64.08 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 114.857 1.428 . . . . 0.0 114.857 177.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.428 HD22 ' CG1' ' A' ' 12' ' ' ILE . 67.0 m-80 -77.36 -7.81 56.68 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 120.433 1.469 . . . . 0.0 111.27 168.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 64.66 32.28 11.44 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.885 1.274 . . . . 0.0 110.713 -167.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 54.1 m170 -83.61 110.3 18.13 Favored 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 166.398 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.5 m -79.67 149.18 31.33 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 169.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -146.64 164.81 31.49 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 125.448 1.499 . . . . 0.0 110.623 176.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 7.6 p -153.72 150.89 11.97 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 CA-C-N 120.372 1.442 . . . . 0.0 113.871 170.028 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 38.6 tp -72.19 135.62 46.17 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.744 2.017 . . . . 0.0 109.301 176.34 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -116.25 -179.74 3.76 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.313 1.045 . . . . 0.0 109.27 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.458 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 14.7 mp0 -60.32 -20.96 61.34 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.885 1.274 . . . . 0.0 113.826 -177.305 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -90.91 16.44 9.45 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.416 1.086 . . . . 0.0 112.552 -173.277 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 61.38 -0.57 0.36 Allowed 'General case' 0 C--O 1.239 0.547 0 C-N-CA 126.855 2.062 . . . . 0.0 114.075 -172.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -82.29 171.99 13.62 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 118.864 0.756 . . . . 0.0 111.164 176.379 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 26.2 m95 -115.57 147.14 41.07 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 168.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -134.55 162.87 55.13 Favored Pre-proline 0 CA--C 1.532 0.256 0 C-N-CA 125.272 1.429 . . . . 0.0 111.272 -169.013 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -72.19 133.15 20.68 Favored 'Trans proline' 0 CA--C 1.535 0.548 0 C-N-CA 123.5 2.8 . . . . 0.0 112.587 -176.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -114.46 29.52 7.96 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.999 1.32 . . . . 0.0 111.432 175.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 70.05 165.35 0.13 Allowed Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 127.615 2.366 . . . . 0.0 111.899 -178.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -70.43 173.01 12.2 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 121.207 1.271 . . . . 0.0 110.259 168.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 12.6 tp -127.19 144.29 50.09 Favored Pre-proline 0 CA--C 1.533 0.322 0 CA-C-O 117.755 -1.117 . . . . 0.0 108.569 -178.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -76.02 169.36 22.27 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 122.761 2.307 . . . . 0.0 110.19 173.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -63.02 -30.31 76.15 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 121.889 1.726 . . . . 0.0 112.918 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -82.1 -21.52 36.71 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 119.385 0.993 . . . . 0.0 111.459 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.22 -16.28 57.72 Favored Glycine 0 CA--C 1.534 1.247 0 O-C-N 121.872 -0.518 . . . . 0.0 112.457 178.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 23.8 tp -61.04 -52.55 64.51 Favored 'General case' 0 C--O 1.232 0.148 0 C-N-CA 126.133 1.773 . . . . 0.0 109.592 172.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -71.65 -34.13 69.49 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 125.306 1.442 . . . . 0.0 109.088 -169.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -52.57 -48.44 66.19 Favored 'General case' 0 CA--C 1.516 -0.333 0 C-N-CA 126.185 1.794 . . . . 0.0 112.081 172.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 28.9 mt -65.01 -58.2 6.72 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.416 177.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 16.4 mm -58.86 -25.0 27.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.339 0 CA-C-O 118.952 -0.546 . . . . 0.0 111.984 -175.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 5.7 ttm180 -46.32 -40.37 11.67 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-O 117.909 -1.043 . . . . 0.0 111.523 173.104 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -67.29 -45.85 75.32 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 119.385 0.993 . . . . 0.0 112.041 -178.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.452 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 10.9 t60 -61.96 -45.43 93.68 Favored 'General case' 0 C--O 1.223 -0.3 0 C-N-CA 124.473 1.109 . . . . 0.0 109.318 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 99.1 m -69.42 -46.11 67.59 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 121.548 -0.72 . . . . 0.0 110.657 -179.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.23 -44.72 95.91 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 118.392 -0.813 . . . . 0.0 110.861 -177.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 8.4 t -67.25 -17.86 64.97 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 117.986 -1.007 . . . . 0.0 112.181 -175.198 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 83.7 mt -110.64 -35.31 6.04 Favored 'General case' 0 C--N 1.341 0.222 0 CA-C-N 119.097 0.862 . . . . 0.0 111.524 -172.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 115.18 17.91 6.52 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.975 1.274 . . . . 0.0 113.293 -179.33 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 20.6 m170 -72.01 159.95 33.33 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-N 118.404 1.102 . . . . 0.0 111.556 -173.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 28.4 p -77.02 -177.15 4.3 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.628 1.971 . . . . 0.0 111.426 175.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 3.0 p -160.43 100.81 1.35 Allowed 'General case' 0 C--O 1.235 0.31 0 C-N-CA 123.533 0.733 . . . . 0.0 112.624 166.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 1.3 p -145.49 168.77 19.77 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.724 0.809 . . . . 0.0 109.643 -168.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 75.18 108.03 0.07 Allowed 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 126.253 1.821 . . . . 0.0 109.898 175.508 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.493 ' HE3' ' CD2' ' A' ' 100' ' ' HIS . 30.8 ttpt 44.36 58.7 3.64 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.183 1.393 . . . . 0.0 111.828 176.751 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 3.8 tpt 47.03 63.33 1.99 Allowed 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.14 1.376 . . . . 0.0 111.249 -171.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 70.98 -65.26 0.35 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.423 1.889 . . . . 0.0 113.569 176.039 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 18.4 mt -141.97 118.63 11.03 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 -161.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . 0.493 ' CD2' ' HE3' ' A' ' 96' ' ' LYS . 13.0 t-160 -69.76 -43.08 72.97 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 118.323 0.51 . . . . 0.0 110.941 172.797 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 67.5 m -145.23 166.89 24.17 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 124.337 1.055 . . . . 0.0 110.199 -164.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 70.4 t -55.35 -35.7 37.86 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 169.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 2.8 tpt -52.76 -47.48 67.43 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 125.151 1.38 . . . . 0.0 112.024 175.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -59.06 -50.86 72.48 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.86 -48.83 78.76 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 125.112 1.365 . . . . 0.0 112.83 -172.445 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 19.9 mm -58.72 -45.1 91.2 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 -176.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -67.58 -43.0 81.63 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 122.725 0.41 . . . . 0.0 111.135 -178.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 44.6 t80 -50.18 -60.1 3.29 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.429 1.091 . . . . 0.0 110.246 176.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 9.0 mp -54.77 -45.79 74.31 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 125.04 1.336 . . . . 0.0 111.933 175.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -61.16 -31.57 71.3 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 119.606 -0.235 . . . . 0.0 111.515 -179.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -78.16 -18.58 55.38 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.923 0.889 . . . . 0.0 112.4 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 47.0 mt -87.16 -43.62 12.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 124.955 1.302 . . . . 0.0 111.104 -177.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -68.53 173.02 5.38 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.303 1.041 . . . . 0.0 112.226 -178.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.211 0 N-CA-C 107.512 -2.235 . . . . 0.0 107.512 178.991 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 83.8 mmm . . . . . 0 N--CA 1.47 0.574 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 72.8 28.12 67.69 Favored Glycine 0 CA--C 1.526 0.744 0 CA-C-O 119.483 -0.621 . . . . 0.0 111.84 -179.009 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -94.41 -40.73 9.76 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 118.223 1.012 . . . . 0.0 113.002 -175.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 146.48 -161.69 28.39 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 107.759 -2.136 . . . . 0.0 107.759 -162.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -135.61 93.58 2.97 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 118.317 1.058 . . . . 0.0 109.48 175.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -127.07 164.41 35.57 Favored Pre-proline 0 N--CA 1.474 0.747 0 C-N-CA 124.989 1.316 . . . . 0.0 111.462 -178.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.45 -47.43 0.18 Allowed 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.558 2.172 . . . . 0.0 111.595 177.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 16.4 t-80 -147.62 148.14 29.91 Favored Pre-proline 0 C--O 1.235 0.311 0 C-N-CA 126.882 2.073 . . . . 0.0 106.738 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -75.91 -32.95 4.05 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 121.318 1.345 . . . . 0.0 112.843 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -84.61 -4.43 58.99 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 117.872 -1.061 . . . . 0.0 112.713 179.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 tt -66.97 127.68 33.47 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 119.786 1.176 . . . . 0.0 108.09 165.03 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 24.1 mm -115.26 119.56 62.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 -177.156 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 75.7 m95 -63.66 152.91 85.12 Favored Pre-proline 0 CA--C 1.538 0.491 0 C-N-CA 123.441 0.696 . . . . 0.0 111.749 -177.021 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -74.36 168.89 75.57 Favored 'Cis proline' 0 CA--C 1.532 0.422 0 N-CA-C 113.376 0.491 . . . . 0.0 113.376 -0.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -126.97 166.88 16.7 Favored 'General case' 0 CA--C 1.521 -0.151 0 C-N-CA 124.024 0.929 . . . . 0.0 111.258 178.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 12.9 mt -143.26 102.37 3.96 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 126.186 1.795 . . . . 0.0 107.051 -178.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.9 tp -78.51 138.08 38.24 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 170.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.418 ' HE3' ' O ' ' A' ' 22' ' ' CYS . 0.0 OUTLIER -134.55 91.63 2.81 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 106.608 -1.626 . . . . 0.0 106.608 170.868 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -55.93 147.79 18.7 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 124.005 0.816 . . . . 0.0 111.974 -174.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -73.5 97.12 2.51 Favored 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 124.731 1.212 . . . . 0.0 110.345 -178.366 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 133.76 -49.43 0.91 Allowed Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 126.282 1.896 . . . . 0.0 108.978 -177.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.418 ' O ' ' HE3' ' A' ' 18' ' ' LYS . 35.8 m -65.41 172.96 2.87 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 124.827 1.251 . . . . 0.0 111.076 -178.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 18.0 m-80 -129.29 -31.2 2.09 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 124.736 1.215 . . . . 0.0 109.302 175.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -67.27 95.71 0.44 Allowed 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 128.19 2.596 . . . . 0.0 108.963 -175.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.411 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 3.1 mm? -53.36 143.61 18.5 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.734 0.813 . . . . 0.0 109.819 178.537 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -111.97 87.42 8.65 Favored Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 125.705 1.602 . . . . 0.0 108.603 173.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -62.55 136.81 60.78 Favored 'Trans proline' 0 CA--C 1.535 0.546 1 C-N-CA 125.712 4.275 . . . . 0.0 111.75 174.164 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -124.14 114.79 20.14 Favored 'General case' 0 N--CA 1.462 0.134 0 C-N-CA 125.961 1.704 . . . . 0.0 108.244 170.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.6 mmm180 -62.35 -56.21 20.61 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 126.057 1.743 . . . . 0.0 109.995 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 61.6 p -139.05 -178.21 5.24 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 124.353 1.061 . . . . 0.0 108.621 178.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -59.67 -29.54 68.14 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.505 -0.747 . . . . 0.0 111.885 167.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -61.67 -23.44 66.09 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.68 0.792 . . . . 0.0 111.168 175.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -84.45 -46.79 11.3 Favored 'General case' 0 C--O 1.223 -0.293 0 C-N-CA 126.335 1.854 . . . . 0.0 109.754 177.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 39.0 t-105 -55.48 -38.5 69.21 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 120.776 -1.203 . . . . 0.0 110.982 175.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 4.4 mm100 -61.34 -43.07 99.49 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.599 1.16 . . . . 0.0 111.85 172.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 69.5 mtt85 -65.67 -43.67 88.61 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 118.572 -0.727 . . . . 0.0 110.988 176.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -56.09 -51.97 65.97 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.117 0.967 . . . . 0.0 110.934 -178.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 1.9 t -65.21 -32.31 73.92 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 119.937 -0.705 . . . . 0.0 110.898 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -77.11 -16.5 59.16 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 -179.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -130.71 21.82 5.04 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 120.147 1.34 . . . . 0.0 111.529 -168.188 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 4.2 m -164.59 -45.85 0.03 OUTLIER 'General case' 0 C--O 1.234 0.255 0 C-N-CA 126.083 1.753 . . . . 0.0 111.05 175.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 6.6 tmtm? 49.16 40.53 17.91 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.633 1.173 . . . . 0.0 112.673 179.206 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.26 170.28 2.38 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.37 -0.831 . . . . 0.0 111.563 176.566 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.419 ' H ' HD11 ' A' ' 44' ' ' LEU 0.301 0.0 OUTLIER -66.14 153.42 42.42 Favored 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 124.953 1.301 . . . . 0.0 112.478 169.376 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.8 mt -137.58 130.18 29.82 Favored 'General case' 0 C--O 1.24 0.563 0 N-CA-C 105.988 -1.856 . . . . 0.0 105.988 172.1 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -136.07 163.99 29.05 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 124.039 0.936 . . . . 0.0 111.591 -168.525 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -69.0 109.86 4.17 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 106.722 -1.584 . . . . 0.0 106.722 -172.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 116.18 -4.71 20.12 Favored Glycine 0 CA--C 1.528 0.879 0 CA-C-O 117.62 -1.655 . . . . 0.0 114.805 -178.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -68.99 -2.64 10.39 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-N 120.703 2.251 . . . . 0.0 116.164 -169.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 9.6 ttmt 51.45 119.0 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 131.56 3.944 . . . . 0.0 116.473 167.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 10.3 mt -106.78 149.27 27.51 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 107.81 -1.182 . . . . 0.0 107.81 165.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 55.4 t -131.31 148.08 32.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 104.556 -2.386 . . . . 0.0 104.556 167.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -127.79 175.3 8.43 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 131.471 3.908 . . . . 0.0 110.36 -169.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.0 p -58.71 -35.19 72.26 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.803 0.841 . . . . 0.0 112.896 -179.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 40.6 m-20 -83.02 -0.43 48.85 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.657 1.583 . . . . 0.0 113.49 -176.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 62.64 22.06 13.09 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 120.028 1.286 . . . . 0.0 111.38 -177.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 34.7 m170 -71.02 103.85 2.82 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 119.85 -1.781 . . . . 0.0 110.086 160.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.07 146.44 54.18 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 120.108 1.322 . . . . 0.0 107.682 171.113 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -134.3 149.25 50.88 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 124.629 1.172 . . . . 0.0 108.091 174.39 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 37.1 t -137.01 140.11 43.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 C-N-CA 126.798 2.039 . . . . 0.0 106.915 175.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 27.9 tp -72.0 138.95 48.33 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 125.738 1.615 . . . . 0.0 107.995 173.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -109.86 168.94 9.05 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 124.32 1.048 . . . . 0.0 110.292 178.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -60.27 -37.65 81.12 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.866 0.867 . . . . 0.0 110.571 178.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -73.48 10.66 0.97 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.95 1.3 . . . . 0.0 113.264 176.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 74.14 7.58 4.72 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 127.803 2.441 . . . . 0.0 114.532 164.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -92.17 168.3 11.45 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.55 1.14 . . . . 0.0 110.296 170.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 58.5 m95 -105.13 96.84 6.8 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 108.177 -1.045 . . . . 0.0 108.177 175.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 53.4 t-80 -69.88 144.39 93.2 Favored Pre-proline 0 CA--C 1.543 0.708 0 CA-C-N 118.013 0.369 . . . . 0.0 110.006 179.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -69.4 103.03 1.04 Allowed 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 124.49 3.46 . . . . 0.0 111.262 171.536 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -83.45 37.01 0.55 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.293 1.837 . . . . 0.0 112.395 -178.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 67.59 165.28 0.12 Allowed Pre-proline 0 CA--C 1.546 0.809 0 C-N-CA 128.002 2.521 . . . . 0.0 112.716 178.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -72.71 174.65 11.42 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 121.526 1.484 . . . . 0.0 113.176 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.6 tt -131.49 143.73 50.42 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 127.157 2.183 . . . . 0.0 108.406 -168.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -89.43 166.47 5.29 Favored 'Trans proline' 0 CA--C 1.538 0.725 0 C-N-CA 124.065 3.177 . . . . 0.0 112.396 -178.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -58.19 -19.58 42.59 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.898 2.399 . . . . 0.0 113.93 178.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -101.56 -17.41 16.4 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 124.127 0.971 . . . . 0.0 111.086 -177.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.53 -40.37 98.67 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.135 -1.186 . . . . 0.0 110.135 174.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 54.6 tp -60.83 -50.21 74.35 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 179.018 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -63.61 -19.64 65.02 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.638 1.175 . . . . 0.0 111.793 -177.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -77.43 -47.13 20.54 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 119.696 1.135 . . . . 0.0 110.793 170.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 29.4 mt -57.63 -54.46 46.58 Favored 'General case' 0 N--CA 1.466 0.367 0 O-C-N 121.807 -0.558 . . . . 0.0 110.305 174.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 20.2 mm -58.11 -33.1 45.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 C-N-CA 125.084 1.354 . . . . 0.0 110.443 -178.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.86 -33.73 37.63 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 119.081 0.855 . . . . 0.0 111.729 174.369 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.4 -54.43 40.43 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 119.159 0.89 . . . . 0.0 110.472 -177.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.411 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 8.6 t60 -64.15 -39.33 93.8 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.478 0.711 . . . . 0.0 109.941 179.072 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 80.6 m -70.2 -40.82 74.37 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 121.327 -0.858 . . . . 0.0 111.405 -178.015 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -75.92 -31.06 58.96 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 118.925 0.784 . . . . 0.0 111.884 -177.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.8 t -66.1 -40.67 90.95 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 176.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 98.0 mt -81.16 -70.7 0.51 Allowed 'General case' 0 C--N 1.341 0.238 0 CA-C-O 118.596 -0.716 . . . . 0.0 109.256 -176.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 153.2 39.63 0.02 OUTLIER Glycine 0 CA--C 1.53 0.989 0 CA-C-O 118.572 -1.127 . . . . 0.0 113.768 171.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -107.14 156.33 18.93 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 118.938 1.369 . . . . 0.0 111.841 -172.035 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 22.5 p -147.03 35.06 0.9 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.288 1.035 . . . . 0.0 113.704 -166.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 5.1 p 58.89 174.62 0.07 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 131.472 3.909 . . . . 0.0 111.357 -171.116 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 18.6 p -128.15 -59.23 1.18 Allowed 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.268 -0.895 . . . . 0.0 110.711 -177.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 5.1 t -147.99 15.49 1.06 Allowed 'General case' 0 C--O 1.233 0.188 0 O-C-N 120.996 -1.065 . . . . 0.0 113.207 -173.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.534 ' HE3' ' HB2' ' A' ' 100' ' ' HIS . 0.7 OUTLIER -141.94 178.33 7.59 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.155 0.982 . . . . 0.0 109.611 177.888 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.98 76.84 2.19 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 126.137 1.775 . . . . 0.0 106.83 176.484 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 58.72 -67.44 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.588 1.155 . . . . 0.0 110.133 -155.648 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 81.3 mt -144.47 171.24 14.63 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 128.385 2.674 . . . . 0.0 110.126 -157.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . 0.534 ' HB2' ' HE3' ' A' ' 96' ' ' LYS . 29.7 t-80 -106.48 -27.16 11.08 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 126.217 1.807 . . . . 0.0 112.156 176.158 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 3.0 m -172.86 172.79 3.96 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.139 1.376 . . . . 0.0 111.392 -172.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 34.7 t -66.56 -44.66 89.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 175.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 51.2 tpp -56.99 -40.11 75.95 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.398 -0.814 . . . . 0.0 111.506 178.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -69.11 -31.33 69.95 Favored 'General case' 0 C--O 1.233 0.195 0 O-C-N 122.17 -0.331 . . . . 0.0 110.85 179.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.24 -46.87 81.88 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.656 1.182 . . . . 0.0 110.043 173.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 42.4 mm -56.68 -37.45 52.9 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.215 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 176.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.46 -47.35 61.03 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 119.331 0.968 . . . . 0.0 111.399 177.176 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -54.41 -55.2 31.14 Favored 'General case' 0 N--CA 1.461 0.083 0 C-N-CA 125.563 1.545 . . . . 0.0 111.57 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 63.7 mt -62.72 -34.86 78.04 Favored 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 124.527 1.131 . . . . 0.0 110.721 -173.218 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -74.18 -44.22 54.28 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 124.293 1.037 . . . . 0.0 110.251 -176.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -64.88 2.5 0.7 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.608 1.563 . . . . 0.0 114.2 178.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 69.7 mt -79.93 -22.02 43.2 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 124.216 1.006 . . . . 0.0 112.1 169.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -86.06 95.95 9.7 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 121.715 0.769 . . . . 0.0 109.799 -174.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.399 0 N-CA-C 108.787 -1.725 . . . . 0.0 108.787 158.262 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.474 0.738 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -157.38 -86.96 0.06 OUTLIER Glycine 0 C--N 1.337 0.622 0 CA-C-N 119.405 1.002 . . . . 0.0 111.617 -170.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 58.69 178.32 0.07 Allowed 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 127.205 2.202 . . . . 0.0 114.214 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 86.02 -83.27 1.62 Allowed Glycine 0 CA--C 1.524 0.617 0 O-C-N 121.381 -0.825 . . . . 0.0 112.859 167.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -149.98 4.4 0.55 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 115.774 1.768 . . . . 0.0 115.774 -165.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -143.84 160.59 49.59 Favored Pre-proline 0 C--N 1.308 -1.234 0 C-N-CA 126.765 2.026 . . . . 0.0 109.561 168.046 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -67.72 -49.27 1.18 Allowed 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.685 2.257 . . . . 0.0 112.002 175.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 4.5 t-80 -158.77 144.88 12.41 Favored Pre-proline 0 CA--C 1.534 0.332 0 CA-C-O 117.645 -1.169 . . . . 0.0 110.81 -175.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -72.24 -20.58 24.43 Favored 'Trans proline' 0 CA--C 1.534 0.486 0 C-N-CA 123.157 2.571 . . . . 0.0 112.96 175.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -85.03 -9.4 58.05 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.282 -0.886 . . . . 0.0 111.9 176.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.3 tt -78.67 132.21 36.95 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 123.957 0.903 . . . . 0.0 109.713 170.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 24.1 mm -120.53 114.11 42.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 176.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -56.5 153.8 19.28 Favored Pre-proline 0 C--O 1.238 0.456 0 CA-C-O 118.874 -0.584 . . . . 0.0 111.642 178.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -68.56 172.16 45.33 Favored 'Cis proline' 0 CA--C 1.535 0.563 0 N-CA-C 114.195 0.806 . . . . 0.0 114.195 -1.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -136.2 171.63 14.19 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.521 0.728 . . . . 0.0 112.132 176.105 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 14.5 mt -143.38 108.32 4.93 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 127.555 2.342 . . . . 0.0 106.901 -177.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.6 tp -83.3 148.38 27.4 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 170.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.66 90.26 1.91 Allowed 'General case' 0 C--O 1.238 0.499 0 CA-C-N 119.739 1.154 . . . . 0.0 109.759 171.07 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.442 HE21 ' CG ' ' A' ' 49' ' ' ASP . 4.8 mt-30 -48.98 152.48 1.05 Allowed 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 125.687 1.595 . . . . 0.0 111.932 -172.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -70.16 -11.18 60.71 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.835 0.68 . . . . 0.0 112.835 173.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -95.79 -17.66 34.86 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 124.995 1.283 . . . . 0.0 113.57 -178.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 1.3 m -129.81 -176.48 3.93 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 119.254 1.527 . . . . 0.0 110.583 -171.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -132.21 -19.47 2.5 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 126.352 1.861 . . . . 0.0 110.612 -176.004 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -67.68 155.36 39.39 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 167.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.438 ' HB2' ' HD1' ' A' ' 85' ' ' HIS . 2.3 mt -102.0 165.11 11.35 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 125.079 1.352 . . . . 0.0 108.937 172.456 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -118.19 88.33 32.11 Favored Pre-proline 0 C--N 1.328 -0.346 0 C-N-CA 125.774 1.63 . . . . 0.0 108.468 171.413 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -62.2 128.59 24.37 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 122.682 2.255 . . . . 0.0 110.225 173.039 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -120.56 109.07 14.82 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.15 1.38 . . . . 0.0 108.056 172.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 79.0 mtm180 -66.14 -47.79 72.91 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 125.344 1.458 . . . . 0.0 113.048 -173.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.14 168.11 22.44 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 126.351 1.86 . . . . 0.0 106.508 -177.468 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 -53.56 -33.28 54.15 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 126.24 1.816 . . . . 0.0 113.628 -176.125 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -56.53 -35.29 67.92 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.49 1.516 . . . . 0.0 111.575 175.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -66.67 -47.27 73.01 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.264 1.826 . . . . 0.0 109.891 -177.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 36.1 t-105 -61.88 -41.27 97.68 Favored 'General case' 0 C--N 1.345 0.38 0 O-C-N 120.771 -1.206 . . . . 0.0 110.719 176.264 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -59.56 -54.79 42.51 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 175.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 61.7 mtp180 -56.71 -34.39 67.42 Favored 'General case' 0 C--O 1.226 -0.147 0 CA-C-O 117.656 -1.164 . . . . 0.0 112.408 179.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -54.15 -68.61 0.17 Allowed 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 119.854 1.206 . . . . 0.0 110.75 177.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -73.31 -10.24 59.54 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 120.049 1.295 . . . . 0.0 111.317 -178.478 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -68.36 -45.75 71.95 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.887 1.222 . . . . 0.0 109.918 167.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -105.28 -16.07 14.87 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 -169.239 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.2 t -151.94 80.81 1.27 Allowed 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 127.928 2.491 . . . . 0.0 107.092 -168.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -75.76 59.68 1.22 Allowed 'General case' 0 N--CA 1.465 0.282 0 O-C-N 121.168 -0.957 . . . . 0.0 109.907 173.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -56.11 150.5 13.84 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 125.736 1.614 . . . . 0.0 108.807 173.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -56.28 129.78 41.77 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.778 1.631 . . . . 0.0 109.302 174.541 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 36.1 mt -118.58 139.48 51.41 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 125.241 1.416 . . . . 0.0 108.239 176.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -144.83 150.38 37.03 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 121.85 0.833 . . . . 0.0 110.647 -166.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.402 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 3.4 m-85 -62.13 130.1 43.88 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 173.508 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 100.55 5.87 53.54 Favored Glycine 0 CA--C 1.527 0.833 0 CA-C-O 118.441 -1.199 . . . . 0.0 114.301 -176.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.442 ' CG ' HE21 ' A' ' 19' ' ' GLN . 5.4 m-20 -75.71 -6.76 52.07 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 115.905 1.817 . . . . 0.0 115.905 -166.775 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 16.2 ttmt 53.07 130.71 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 130.238 3.415 . . . . 0.0 116.692 173.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 5.9 tp -122.02 154.76 36.83 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 175.402 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 41.0 t -138.04 131.6 41.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 C-N-CA 126.587 1.955 . . . . 0.0 107.0 175.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -107.14 -178.75 3.73 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.446 1.498 . . . . 0.0 113.41 178.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.6 t -56.72 -13.94 2.91 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 128.385 2.674 . . . . 0.0 115.103 177.596 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -122.69 11.87 9.84 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 126.823 2.049 . . . . 0.0 109.733 -173.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 66.96 16.43 10.36 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.895 1.678 . . . . 0.0 110.589 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 25.0 m170 -61.45 108.53 0.96 Allowed 'General case' 0 C--O 1.24 0.565 0 CA-C-N 120.363 1.438 . . . . 0.0 107.995 168.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -82.29 149.42 27.8 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 173.556 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -138.55 164.49 29.3 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 171.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 25.6 t -133.27 138.78 50.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 C-N-CA 128.087 2.555 . . . . 0.0 106.425 172.188 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 16.0 tp -80.16 137.32 36.68 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 171.155 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -121.84 170.91 9.31 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.38 1.072 . . . . 0.0 110.371 174.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.563 ' H ' ' CD ' ' A' ' 63' ' ' GLU . 0.7 OUTLIER -66.99 -18.57 65.45 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.584 1.553 . . . . 0.0 111.433 -171.086 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -78.16 16.45 0.76 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.903 1.281 . . . . 0.0 110.958 172.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 61.45 0.97 0.5 Allowed 'General case' 0 C--O 1.239 0.549 0 C-N-CA 129.746 3.219 . . . . 0.0 114.979 176.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 2.2 p-80 -85.12 156.49 21.03 Favored 'General case' 0 N--CA 1.437 -1.105 0 CA-C-O 121.781 0.801 . . . . 0.0 109.269 175.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 81.4 m95 -83.93 142.52 30.48 Favored 'General case' 0 N--CA 1.437 -1.077 0 N-CA-C 104.801 -2.296 . . . . 0.0 104.801 153.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 22.3 t-80 -114.1 143.99 30.76 Favored Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 171.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.78 103.3 0.98 Allowed 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 124.574 3.516 . . . . 0.0 111.058 176.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -79.6 29.91 0.24 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.705 1.602 . . . . 0.0 111.857 177.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 66.5 165.47 0.12 Allowed Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 128.156 2.583 . . . . 0.0 111.705 -173.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -63.36 170.23 8.34 Favored 'Trans proline' 0 N--CA 1.45 -1.034 0 C-N-CA 121.179 1.253 . . . . 0.0 110.864 167.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 13.4 tp -123.82 145.83 48.82 Favored Pre-proline 0 C--O 1.237 0.421 0 C-N-CA 124.519 1.127 . . . . 0.0 109.211 -174.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -61.46 158.78 34.6 Favored 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 123.33 2.686 . . . . 0.0 111.484 174.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -59.2 -27.23 84.45 Favored 'Trans proline' 0 N--CA 1.457 -0.674 0 C-N-CA 122.634 2.223 . . . . 0.0 112.398 179.159 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -96.11 -12.37 24.88 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.599 0.76 . . . . 0.0 111.102 -173.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.43 -28.12 68.37 Favored Glycine 0 CA--C 1.527 0.833 0 C-N-CA 123.807 0.718 . . . . 0.0 111.753 175.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 36.4 tp -52.95 -59.23 4.78 Favored 'General case' 0 C--N 1.34 0.158 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 165.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -62.59 -20.13 64.42 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.898 1.279 . . . . 0.0 112.13 -169.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -75.48 -44.94 41.35 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.577 1.151 . . . . 0.0 111.141 172.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 41.4 mt -61.65 -44.09 97.63 Favored 'General case' 0 C--O 1.234 0.257 0 O-C-N 121.009 -1.057 . . . . 0.0 110.08 173.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 37.0 mm -56.95 -41.52 77.02 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 123.25 0.62 . . . . 0.0 109.514 173.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -50.38 -42.83 54.0 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 124.413 1.085 . . . . 0.0 112.309 -179.18 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -67.44 -43.63 80.66 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 119.1 0.864 . . . . 0.0 110.952 -179.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.438 ' HD1' ' HB2' ' A' ' 25' ' ' LEU . 3.9 t-160 -58.68 -46.38 87.36 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 177.356 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 30.5 m -60.41 -44.31 95.84 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-O 118.361 -0.828 . . . . 0.0 111.244 175.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -71.48 -27.78 63.47 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 117.623 -1.179 . . . . 0.0 112.094 -172.072 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 8.4 t -70.86 -40.77 72.11 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 119.984 1.266 . . . . 0.0 108.872 177.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 58.8 mt -89.47 -63.5 1.28 Allowed 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 -174.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 157.7 9.57 0.05 OUTLIER Glycine 0 CA--C 1.536 1.351 0 C-N-CA 125.412 1.482 . . . . 0.0 114.428 174.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 21.6 p80 -109.31 48.58 0.87 Allowed 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 120.354 2.077 . . . . 0.0 114.237 -150.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 69.3 m -60.39 170.48 1.33 Allowed 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.062 -1.649 . . . . 0.0 111.658 179.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -49.4 150.97 1.65 Allowed 'General case' 0 C--O 1.234 0.258 0 C-N-CA 125.594 1.558 . . . . 0.0 112.463 -167.433 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 82.7 p -129.03 -38.1 1.65 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.189 -179.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -141.25 156.27 45.91 Favored 'General case' 0 N--CA 1.438 -1.059 0 C-N-CA 125.512 1.525 . . . . 0.0 109.455 -170.166 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . 0.316 0.0 OUTLIER 44.61 -162.98 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 127.116 2.166 . . . . 0.0 113.262 178.835 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 11.3 ptm -71.84 59.37 0.35 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.218 1.007 . . . . 0.0 110.292 167.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 67.39 -69.92 0.13 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.849 1.659 . . . . 0.0 109.658 -173.753 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 75.2 mt -142.67 141.3 31.84 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 126.643 1.977 . . . . 0.0 109.37 -169.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 9.8 t-160 -75.75 -27.22 58.01 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.063 0.545 . . . . 0.0 112.082 -174.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 11.2 p 179.69 179.56 0.49 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.191 1.396 . . . . 0.0 109.692 -174.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 6.5 t -64.65 -45.53 95.09 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.21 0 C-N-CA 123.58 0.752 . . . . 0.0 109.054 -178.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 6.7 tpt -62.98 -32.82 74.25 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 121.727 -0.608 . . . . 0.0 110.682 -177.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.76 -37.84 70.46 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.186 0.994 . . . . 0.0 109.491 177.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.74 -43.15 97.35 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 125.635 1.574 . . . . 0.0 112.455 176.159 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 33.9 mm -61.26 -50.63 79.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -179.503 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -66.34 -39.16 89.02 Favored 'General case' 0 C--O 1.226 -0.177 0 O-C-N 123.369 0.418 . . . . 0.0 110.326 -176.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -53.91 -56.37 18.36 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 124.548 1.139 . . . . 0.0 111.117 172.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 31.7 mt -62.43 -38.78 91.04 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 111.761 0.282 . . . . 0.0 111.761 -177.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -64.87 -41.41 95.69 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 177.244 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -70.33 -13.35 62.11 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 118.111 -0.947 . . . . 0.0 113.161 -178.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 94.9 mt -60.9 -34.12 74.17 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 120.082 1.31 . . . . 0.0 110.934 172.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.23 158.87 28.81 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 125.618 1.567 . . . . 0.0 112.496 -167.207 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.018 0 C-N-CA 127.333 2.397 . . . . 0.0 107.676 167.38 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.0 mmm . . . . . 0 N--CA 1.474 0.752 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -64.16 153.43 48.25 Favored Glycine 0 CA--C 1.524 0.635 0 CA-C-O 121.328 0.405 . . . . 0.0 112.922 -175.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -151.83 163.56 38.93 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 126.059 1.744 . . . . 0.0 108.221 174.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.54 ' C ' ' H ' ' A' ' 6' ' ' THR . . . -155.45 165.52 32.44 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 107.505 -2.238 . . . . 0.0 107.505 163.6 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 43.95 3.74 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 131.065 3.746 . . . . 0.0 118.751 -170.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.54 ' H ' ' C ' ' A' ' 4' ' ' GLY . 0.1 OUTLIER -155.67 164.93 19.59 Favored Pre-proline 0 C--N 1.316 -0.87 1 C-N-CA 131.739 4.016 . . . . 0.0 109.188 -178.618 . . . . . . . . 4 4 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -77.92 -165.08 0.31 Allowed 'Trans proline' 0 CA--C 1.548 1.185 0 C-N-CA 124.418 3.412 . . . . 0.0 111.96 179.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 26.8 t-80 -53.6 143.73 36.71 Favored Pre-proline 0 CA--C 1.539 0.541 0 C-N-CA 124.496 1.118 . . . . 0.0 110.759 -173.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -71.51 6.12 2.07 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 C-N-CA 123.907 3.071 . . . . 0.0 114.879 -177.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -125.23 -5.86 7.2 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.143 1.377 . . . . 0.0 112.317 177.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.7 tt -54.98 151.55 8.69 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 119.578 1.081 . . . . 0.0 109.931 166.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 12.6 mm -127.04 140.61 48.6 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.115 0 N-CA-C 105.928 -1.879 . . . . 0.0 105.928 174.331 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 78.9 m95 -81.04 159.96 67.04 Favored Pre-proline 0 CA--C 1.537 0.459 0 O-C-N 121.938 -0.476 . . . . 0.0 110.889 177.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.77 170.68 52.84 Favored 'Cis proline' 0 N--CA 1.455 -0.751 0 C-N-CA 124.866 -0.889 . . . . 0.0 112.621 -11.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -136.61 170.91 15.29 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.073 0.949 . . . . 0.0 111.544 -179.175 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 15.7 mt -142.68 103.38 4.21 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 127.611 2.364 . . . . 0.0 108.103 -171.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.0 tp -81.1 156.1 25.95 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 118.385 -0.817 . . . . 0.0 108.82 172.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -136.87 78.05 1.68 Allowed 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 120.321 1.419 . . . . 0.0 111.425 172.63 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -45.81 119.79 2.37 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 126.236 1.814 . . . . 0.0 110.972 -169.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.68 99.37 1.67 Allowed 'General case' 0 N--CA 1.44 -0.959 0 C-N-CA 122.958 0.503 . . . . 0.0 110.382 -164.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 132.79 -46.9 1.03 Allowed Glycine 0 CA--C 1.532 1.106 0 C-N-CA 127.743 2.592 . . . . 0.0 109.625 -173.17 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 74.9 m -68.33 -33.57 74.54 Favored 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 126.646 1.978 . . . . 0.0 114.319 -169.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 68.85 -27.04 0.15 Allowed 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 127.271 2.228 . . . . 0.0 114.422 -176.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -52.7 116.58 2.38 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 127.627 2.371 . . . . 0.0 109.569 169.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.529 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 4.4 mm? -73.32 136.93 44.53 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 106.908 -1.516 . . . . 0.0 106.908 168.107 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -106.73 87.07 2.58 Favored Pre-proline 0 C--O 1.239 0.529 0 C-N-CA 127.319 2.247 . . . . 0.0 108.652 -176.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -61.82 147.37 95.39 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 122.21 1.94 . . . . 0.0 109.74 176.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.2 mt -138.59 116.71 11.77 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 105.542 -2.021 . . . . 0.0 105.542 178.305 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 25.4 mtt-85 -82.16 -39.55 23.07 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 120.615 1.552 . . . . 0.0 114.305 -175.143 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.7 t -145.91 -177.04 5.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 120.367 1.439 . . . . 0.0 108.802 167.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.96 -25.77 58.49 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.39 1.876 . . . . 0.0 112.576 -178.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -68.24 -29.62 68.48 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.08 0.952 . . . . 0.0 111.212 173.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -70.28 -33.39 71.52 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 121.252 -0.905 . . . . 0.0 110.407 -176.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 46.1 t-105 -60.86 -32.97 72.38 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.754 -0.592 . . . . 0.0 111.35 170.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 -66.75 -42.77 85.63 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 118.474 0.579 . . . . 0.0 111.162 173.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? -54.22 -44.13 71.41 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 119.047 0.84 . . . . 0.0 110.243 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -58.2 -50.46 73.46 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-O 119.565 -0.255 . . . . 0.0 110.828 178.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 15.1 p -73.66 -14.07 61.1 Favored 'General case' 0 N--CA 1.464 0.246 0 O-C-N 119.982 -1.699 . . . . 0.0 113.32 -176.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.06 -34.62 71.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 117.614 -1.184 . . . . 0.0 111.122 166.357 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -120.68 -15.64 8.39 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 116.407 2.002 . . . . 0.0 116.407 -167.213 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 49.8 m -138.79 11.58 2.68 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 129.979 3.312 . . . . 0.0 109.994 -175.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 45.3 37.94 3.17 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 127.46 2.304 . . . . 0.0 113.458 161.057 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . 0.271 0.7 OUTLIER 48.67 30.09 2.42 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 125.002 1.321 . . . . 0.0 113.547 178.962 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.8 mt -54.37 116.15 2.48 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 106.073 -1.825 . . . . 0.0 106.073 164.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 90.3 mt -143.2 118.17 10.01 Favored 'General case' 0 C--O 1.24 0.575 0 N-CA-C 102.117 -3.29 . . . . 0.0 102.117 -176.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -118.24 160.85 20.89 Favored 'General case' 0 C--O 1.234 0.284 0 O-C-N 123.858 0.724 . . . . 0.0 110.038 -170.633 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -66.04 124.01 21.42 Favored 'General case' 0 CA--C 1.514 -0.429 0 C-N-CA 120.161 -0.616 . . . . 0.0 109.362 -164.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 103.6 0.82 46.5 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-O 117.747 -1.585 . . . . 0.0 113.821 -176.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -55.8 -29.37 59.61 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.808 1.643 . . . . 0.0 113.797 -167.652 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 17.5 ttmt 54.97 155.08 0.01 OUTLIER 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 128.672 2.789 . . . . 0.0 114.889 -179.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.1 mt -141.87 140.82 32.99 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.089 174.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 99.0 t -134.05 120.87 36.74 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 125.322 1.449 . . . . 0.0 108.479 177.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 26.5 p30 -99.78 173.41 6.71 Favored 'General case' 0 C--N 1.329 -0.296 1 C-N-CA 132.018 4.127 . . . . 0.0 111.181 178.745 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.25 2.69 0.05 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.837 1.655 . . . . 0.0 114.65 174.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -123.44 5.14 9.02 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.921 1.688 . . . . 0.0 110.581 -174.342 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.41 ' CE2' ' HA ' ' A' ' 75' ' ' PRO . 11.7 m-85 61.82 14.88 6.59 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.188 1.795 . . . . 0.0 112.877 172.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 8.9 m170 -66.01 109.05 2.41 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 124.708 1.203 . . . . 0.0 109.713 163.235 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 97.4 m -72.15 140.15 48.66 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 118.168 -1.413 . . . . 0.0 108.43 166.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 55.1 m-85 -124.94 159.89 30.14 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-O 117.749 -1.12 . . . . 0.0 108.76 165.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 1.6 p -150.28 153.29 10.61 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.419 0 CA-C-N 120.522 1.51 . . . . 0.0 112.402 171.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 17.5 tp -77.87 131.9 37.72 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 126.071 1.748 . . . . 0.0 108.727 -177.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -105.75 174.61 5.81 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 123.74 0.816 . . . . 0.0 110.479 179.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -68.89 -2.42 9.62 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.272 -0.893 . . . . 0.0 112.927 172.559 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -85.87 0.78 52.17 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 120.369 -1.457 . . . . 0.0 112.153 165.006 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 51.87 8.94 0.07 Allowed 'General case' 0 C--O 1.237 0.426 0 C-N-CA 128.104 2.562 . . . . 0.0 113.953 -164.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -77.72 174.16 11.27 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 167.55 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 74.7 m95 -114.49 136.94 52.46 Favored 'General case' 0 N--CA 1.44 -0.944 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 -179.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -118.31 144.71 35.59 Favored Pre-proline 0 N--CA 1.45 -0.472 0 C-N-CA 126.013 1.725 . . . . 0.0 110.401 -170.305 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -79.28 101.97 1.47 Allowed 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 124.697 3.598 . . . . 0.0 110.073 -178.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -83.35 24.68 0.8 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.212 1.405 . . . . 0.0 112.625 179.432 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 67.8 165.11 0.13 Allowed Pre-proline 0 CA--C 1.543 0.679 0 C-N-CA 128.836 2.854 . . . . 0.0 111.99 -178.09 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -70.54 175.38 8.82 Favored 'Trans proline' 0 N--CA 1.452 -0.956 0 C-N-CA 121.263 1.309 . . . . 0.0 111.947 175.062 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 13.4 tp -126.6 155.36 74.9 Favored Pre-proline 0 CA--C 1.539 0.549 0 C-N-CA 126.813 2.045 . . . . 0.0 108.772 -172.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -73.14 165.67 32.07 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 121.793 1.662 . . . . 0.0 110.113 164.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.41 ' HA ' ' CE2' ' A' ' 56' ' ' PHE . 18.5 Cg_endo -59.32 -36.41 94.63 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.544 2.163 . . . . 0.0 112.459 177.767 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -78.97 -25.29 43.47 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 122.455 0.302 . . . . 0.0 110.245 -174.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.13 -24.58 67.28 Favored Glycine 0 CA--C 1.53 1.029 0 CA-C-O 119.137 -0.813 . . . . 0.0 113.189 -174.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 23.4 tp -55.09 -46.16 75.48 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 124.832 1.253 . . . . 0.0 109.962 168.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -75.39 -15.26 60.47 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 123.603 0.761 . . . . 0.0 110.632 -168.583 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -68.36 -44.84 74.34 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.063 -1.023 . . . . 0.0 110.981 164.215 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.8 mp -58.15 -56.93 15.75 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 175.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 6.0 mm -53.19 -34.19 21.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 C-N-CA 125.059 1.344 . . . . 0.0 110.986 -178.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 12.2 ttt-85 -48.02 -38.89 18.22 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 119.381 0.992 . . . . 0.0 112.559 175.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -71.37 -42.96 67.77 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.373 0.988 . . . . 0.0 111.773 -179.074 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.529 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 13.5 t60 -55.24 -55.05 35.72 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.778 0.799 . . . . 0.0 109.281 170.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 95.1 m -68.29 -29.04 67.73 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 121.324 -0.86 . . . . 0.0 111.333 -172.13 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -78.95 -24.26 44.04 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 117.373 -1.299 . . . . 0.0 112.602 178.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.4 t -92.6 -17.75 23.97 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.914 0.779 . . . . 0.0 110.821 -177.136 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 70.1 mt -107.28 -22.35 12.63 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.581 0.752 . . . . 0.0 111.877 178.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 79.96 53.83 4.09 Favored Glycine 0 C--N 1.337 0.614 0 N-CA-C 110.913 -0.875 . . . . 0.0 110.913 -177.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 35.3 m-70 -106.61 -36.67 6.67 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 122.969 0.508 . . . . 0.0 110.673 177.052 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 37.3 m 52.64 -164.87 0.07 Allowed 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.241 1.016 . . . . 0.0 112.187 -173.006 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 1.5 p -88.92 179.58 6.15 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 126.462 1.905 . . . . 0.0 111.672 -179.084 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 40.2 p -135.46 -77.77 0.44 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.039 1.336 . . . . 0.0 108.894 -178.171 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 69.1 m -132.9 178.71 6.67 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 126.491 1.916 . . . . 0.0 109.224 174.251 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . 0.394 0.0 OUTLIER 44.57 33.7 0.97 Allowed 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 128.321 2.648 . . . . 0.0 114.948 178.664 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 12.3 ttp 58.81 73.29 0.49 Allowed 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 125.375 1.47 . . . . 0.0 108.567 -178.314 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 7.9 m80 73.31 -75.31 0.08 Allowed 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 127.246 2.218 . . . . 0.0 111.831 -171.001 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 84.5 mt -150.69 154.39 37.32 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 124.519 1.128 . . . . 0.0 109.655 -159.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 16.0 t-160 -83.85 -40.01 19.2 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 124.571 1.169 . . . . 0.0 111.397 173.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 88.8 p -172.26 -175.36 1.4 Allowed 'General case' 0 C--O 1.236 0.351 0 C-N-CA 124.241 1.017 . . . . 0.0 110.414 -171.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 67.5 t -55.0 -45.27 76.67 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.291 0 C-N-CA 125.106 1.362 . . . . 0.0 110.329 177.641 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 2.8 ttm -62.29 -45.63 92.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 118.527 0.603 . . . . 0.0 110.113 -171.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.55 -39.8 85.18 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 124.559 1.144 . . . . 0.0 110.08 173.167 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.62 -53.82 51.07 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 123.691 0.796 . . . . 0.0 111.566 178.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 32.4 mm -53.86 -47.08 64.19 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 -178.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -60.12 -51.54 69.16 Favored 'General case' 0 CA--C 1.521 -0.153 0 C-N-CA 123.71 0.804 . . . . 0.0 111.163 -179.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 13.0 t80 -53.27 -65.13 0.62 Allowed 'General case' 0 C--O 1.221 -0.42 0 C-N-CA 126.371 1.868 . . . . 0.0 110.176 178.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 9.2 mp -52.29 -45.12 65.36 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 125.784 1.634 . . . . 0.0 112.015 -178.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -65.35 -33.98 77.23 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 118.668 0.667 . . . . 0.0 111.548 177.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -80.57 -18.74 47.4 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.741 0.816 . . . . 0.0 112.836 177.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 63.6 mt -77.56 -28.53 51.82 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 124.317 1.047 . . . . 0.0 110.98 173.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -71.69 162.51 29.33 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-O 121.649 0.738 . . . . 0.0 112.066 174.709 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.358 0 CA-C-O 122.714 1.174 . . . . 0.0 111.267 173.601 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.2 tpp . . . . . 0 N--CA 1.468 0.462 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 172.87 -64.1 0.13 Allowed Glycine 0 N--CA 1.449 -0.438 0 N-CA-C 105.796 -2.922 . . . . 0.0 105.796 -176.557 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -147.97 160.0 43.29 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 124.567 1.147 . . . . 0.0 108.016 160.379 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -96.65 -27.13 9.96 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 110.411 -1.076 . . . . 0.0 110.411 163.167 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 53.41 9.26 0.15 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.984 2.113 . . . . 0.0 114.332 -172.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.02 160.1 76.98 Favored Pre-proline 0 C--O 1.238 0.489 0 C-N-CA 128.146 2.578 . . . . 0.0 111.662 -175.391 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -71.91 70.23 2.91 Favored 'Trans proline' 0 N--CA 1.45 -1.062 0 C-N-CA 123.076 2.517 . . . . 0.0 110.089 169.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . 0.496 ' HD1' ' HB2' ' A' ' 10' ' ' GLN . 1.3 t-80 75.55 148.09 0.12 Allowed Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 129.098 2.959 . . . . 0.0 113.432 -176.812 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -78.1 -28.74 4.61 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 122.688 2.259 . . . . 0.0 113.25 173.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.496 ' HB2' ' HD1' ' A' ' 8' ' ' HIS . 1.6 mm-40 -69.93 -22.34 63.2 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.701 1.137 . . . . 0.0 112.293 176.322 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 tt -63.77 135.56 56.74 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 166.368 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 3.0 tt -107.85 178.92 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.165 0 C-N-CA 124.286 1.035 . . . . 0.0 108.443 176.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 58.2 m95 -122.87 149.87 57.49 Favored Pre-proline 0 C--O 1.237 0.4 0 O-C-N 121.586 -0.696 . . . . 0.0 109.568 172.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -68.69 162.59 80.6 Favored 'Cis proline' 0 CA--C 1.542 0.917 0 N-CA-C 114.713 1.005 . . . . 0.0 114.713 -1.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -139.8 169.79 17.08 Favored 'General case' 0 CA--C 1.519 -0.219 0 C-N-CA 127.088 2.155 . . . . 0.0 110.967 -177.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -138.79 112.93 8.64 Favored 'General case' 0 N--CA 1.436 -1.164 0 C-N-CA 126.895 2.078 . . . . 0.0 108.597 -156.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 22.2 tp -99.72 151.51 21.15 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 123.772 0.67 . . . . 0.0 109.469 169.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.48 88.54 2.15 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 171.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.536 ' NE2' HE21 ' A' ' 46' ' ' GLN . 0.8 OUTLIER -52.94 138.0 31.17 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 118.195 0.452 . . . . 0.0 110.381 -171.649 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -59.02 109.92 0.93 Allowed 'General case' 0 N--CA 1.433 -1.321 0 C-N-CA 124.69 1.196 . . . . 0.0 108.364 178.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 110.09 -36.17 4.43 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 126.201 1.858 . . . . 0.0 112.825 -179.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 1.8 p -69.45 171.27 9.0 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 119.661 1.731 . . . . 0.0 109.151 177.083 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 11.5 m-80 -116.8 -16.49 10.62 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.622 -1.172 . . . . 0.0 108.883 172.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -76.83 109.59 10.75 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 124.359 1.064 . . . . 0.0 108.851 -170.286 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -68.74 137.22 53.88 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 108.164 -1.051 . . . . 0.0 108.164 172.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -107.05 88.41 3.7 Favored Pre-proline 0 C--N 1.327 -0.391 0 C-N-CA 128.844 2.858 . . . . 0.0 112.786 -170.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -66.39 120.79 7.96 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 122.194 1.929 . . . . 0.0 111.28 174.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -111.99 107.78 16.87 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 126.805 2.042 . . . . 0.0 106.074 168.102 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 4.4 mtt-85 -59.73 -49.55 77.29 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.093 0.557 . . . . 0.0 110.206 178.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 22.3 p -140.4 174.68 10.28 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 123.348 0.659 . . . . 0.0 109.642 178.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -56.55 -36.41 69.24 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 124.543 1.137 . . . . 0.0 111.479 178.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.5 -30.93 71.97 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-N 118.959 0.8 . . . . 0.0 110.177 -177.617 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -69.1 -40.6 78.3 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-N 119.43 1.014 . . . . 0.0 111.197 174.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 13.0 t-105 -56.7 -43.32 80.4 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.254 0.622 . . . . 0.0 110.514 175.128 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -62.6 -55.95 22.36 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 174.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.78 -24.72 67.02 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 124.085 0.954 . . . . 0.0 112.726 -173.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -58.49 -63.78 1.16 Allowed 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 124.6 1.16 . . . . 0.0 109.159 172.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 11.6 t -66.29 -30.83 71.33 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 118.606 0.639 . . . . 0.0 110.971 -177.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.75 -2.57 15.09 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-O 118.114 -0.946 . . . . 0.0 111.536 176.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -129.06 37.47 4.06 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.754 1.222 . . . . 0.0 111.548 169.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 32.1 t 70.86 -80.2 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.428 1.491 . . . . 0.0 110.003 -179.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 29.2 mmtm 44.35 56.25 5.08 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 126.033 1.733 . . . . 0.0 112.15 -178.525 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 69.4 -164.35 0.18 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.176 0.99 . . . . 0.0 110.31 171.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.2 mp -97.16 -175.76 3.33 Favored 'General case' 0 CA--C 1.53 0.18 0 O-C-N 121.271 -0.893 . . . . 0.0 110.368 -170.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 56.6 mt -130.35 128.12 40.81 Favored 'General case' 0 N--CA 1.456 -0.144 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 166.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.536 HE21 ' NE2' ' A' ' 19' ' ' GLN . 43.6 mt-30 -118.53 140.96 49.05 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 125.223 1.409 . . . . 0.0 108.363 -179.14 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.423 ' HA ' ' HB3' ' A' ' 61' ' ' LEU . 43.1 m-85 -63.79 108.99 1.58 Allowed 'General case' 0 C--O 1.234 0.259 0 N-CA-C 107.051 -1.463 . . . . 0.0 107.051 170.741 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 131.8 -12.58 5.36 Favored Glycine 0 CA--C 1.527 0.791 0 CA-C-O 118.919 -0.934 . . . . 0.0 112.866 -178.335 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -60.22 -10.76 4.93 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 127.134 2.173 . . . . 0.0 115.914 -166.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.6 ttmt 54.18 124.31 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 129.763 3.225 . . . . 0.0 114.786 175.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -99.62 149.94 22.76 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 161.217 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 24.1 t -128.98 152.3 36.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 C-N-CA 128.327 2.651 . . . . 0.0 105.189 164.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -133.5 179.41 6.23 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.216 1.406 . . . . 0.0 110.86 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.4 m -70.28 -10.69 59.68 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 178.459 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 62.8 m-80 -85.94 -3.46 58.93 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 124.347 1.059 . . . . 0.0 111.356 170.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 60.55 23.25 12.96 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.226 1.01 . . . . 0.0 110.157 -170.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 49.2 m170 -75.34 114.42 13.86 Favored 'General case' 0 C--O 1.232 0.176 0 O-C-N 120.655 -1.278 . . . . 0.0 109.035 167.043 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 23.2 m -78.43 153.17 31.72 Favored 'General case' 0 C--O 1.239 0.5 0 N-CA-C 108.334 -0.988 . . . . 0.0 108.334 169.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -139.45 152.26 46.88 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.759 1.624 . . . . 0.0 107.861 171.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 63.0 t -136.29 144.25 33.52 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 127.848 2.459 . . . . 0.0 106.927 175.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.423 ' HB3' ' HA ' ' A' ' 47' ' ' TYR . 0.5 OUTLIER -81.02 134.41 35.67 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 127.331 2.252 . . . . 0.0 110.034 -178.493 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -109.97 168.48 9.4 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.729 1.15 . . . . 0.0 111.594 174.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -61.3 -15.09 31.92 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 120.384 -1.447 . . . . 0.0 112.876 178.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.05 -2.0 22.47 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 126.591 1.957 . . . . 0.0 112.63 171.66 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 74.4 -12.16 0.93 Allowed 'General case' 0 C--N 1.346 0.427 0 C-N-CA 127.009 2.124 . . . . 0.0 111.653 -175.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.2 p-80 -75.21 156.86 35.35 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 119.348 0.976 . . . . 0.0 112.054 177.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 65.9 m95 -104.08 96.19 6.49 Favored 'General case' 0 N--CA 1.436 -1.139 0 N-CA-C 105.211 -2.144 . . . . 0.0 105.211 174.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -81.54 161.26 62.34 Favored Pre-proline 0 C--O 1.239 0.543 0 C-N-CA 124.06 0.944 . . . . 0.0 109.847 177.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -74.34 148.95 39.28 Favored 'Trans proline' 0 N--CA 1.449 -1.095 0 C-N-CA 122.722 2.281 . . . . 0.0 109.136 -175.29 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -138.89 37.03 2.16 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.172 0.989 . . . . 0.0 110.757 -171.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 65.32 164.42 0.12 Allowed Pre-proline 0 CA--C 1.541 0.618 0 C-N-CA 129.001 2.92 . . . . 0.0 113.096 -174.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -69.97 -178.6 2.5 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 121.758 1.638 . . . . 0.0 111.699 169.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.9 tt -128.38 143.72 49.24 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 125.775 1.63 . . . . 0.0 108.858 -172.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -82.87 164.96 15.59 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.679 2.919 . . . . 0.0 111.155 -176.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -60.07 -28.32 86.78 Favored 'Trans proline' 0 CA--C 1.535 0.565 0 C-N-CA 121.612 1.542 . . . . 0.0 113.15 -178.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -84.24 -20.52 32.1 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.66 0.784 . . . . 0.0 112.731 175.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.65 -26.66 70.02 Favored Glycine 0 C--N 1.341 0.82 0 CA-C-N 119.154 0.888 . . . . 0.0 111.371 -173.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 18.5 tp -61.23 -52.3 65.35 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 126.391 1.876 . . . . 0.0 108.418 175.041 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -62.93 -34.95 78.54 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 123.128 0.571 . . . . 0.0 109.969 179.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.65 -32.44 73.76 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 127.055 2.142 . . . . 0.0 112.566 178.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.5 mp -67.07 -66.69 0.53 Allowed 'General case' 0 C--O 1.233 0.208 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 165.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 12.7 mm -53.65 -29.46 17.42 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 C-N-CA 125.941 1.697 . . . . 0.0 112.048 -171.103 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.7 mtp180 -44.82 -46.7 10.83 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 126.312 1.845 . . . . 0.0 110.979 173.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.74 -47.09 85.07 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.947 0.794 . . . . 0.0 111.637 179.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -59.45 -49.36 78.1 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.872 0.869 . . . . 0.0 109.822 179.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 84.8 m -69.17 -26.53 64.9 Favored 'General case' 0 C--N 1.329 -0.287 0 O-C-N 120.972 -1.08 . . . . 0.0 111.307 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -78.41 -14.74 59.25 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.469 1.108 . . . . 0.0 113.427 177.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.5 t -98.37 -16.86 19.14 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.968 0.804 . . . . 0.0 111.488 178.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 86.8 mt -109.41 -41.49 4.6 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.468 1.107 . . . . 0.0 110.84 178.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 103.83 64.8 0.69 Allowed Glycine 0 C--N 1.334 0.426 0 C-N-CA 125.093 1.33 . . . . 0.0 111.428 -178.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 10.1 m-70 -130.44 171.77 12.61 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 122.373 1.082 . . . . 0.0 111.46 177.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.8 p -146.36 160.02 42.6 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 126.101 1.76 . . . . 0.0 107.064 167.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . 0.527 ' H ' ' CD2' ' A' ' 98' ' ' HIS 0.464 0.5 OUTLIER -122.39 158.27 30.05 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 125.697 1.599 . . . . 0.0 108.148 165.939 . . . . . . . . 4 4 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 3.4 t -155.29 -44.23 0.08 Allowed 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 -179.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 15.0 m -50.43 101.38 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.466 1.507 . . . . 0.0 111.478 179.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.496 ' HE2' ' CD2' ' A' ' 100' ' ' HIS . 64.4 tttt 58.81 75.32 0.4 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.204 1.402 . . . . 0.0 110.5 -171.592 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 7.4 tpt 52.65 54.91 9.81 Favored 'General case' 0 CA--C 1.527 0.086 0 C-N-CA 126.907 2.083 . . . . 0.0 111.502 168.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . 0.527 ' CD2' ' H ' ' A' ' 93' ' ' CYS . 5.7 m80 60.06 -80.58 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 -167.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 95.3 mt -133.59 104.91 6.59 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.427 1.491 . . . . 0.0 109.186 -164.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . 0.496 ' CD2' ' HE2' ' A' ' 96' ' ' LYS . 2.0 t-80 -45.53 -40.7 8.9 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 127.877 2.471 . . . . 0.0 114.691 178.367 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 34.6 t -161.16 165.94 28.68 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 -168.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 45.5 t -61.64 -42.88 95.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 175.513 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 4.5 ttm -56.51 -44.89 81.17 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 123.752 0.821 . . . . 0.0 111.58 177.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.54 -38.42 87.1 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 110.395 -0.224 . . . . 0.0 110.395 177.865 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.98 -36.32 74.67 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 118.302 -0.856 . . . . 0.0 112.269 175.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.4 mm -57.46 -57.72 9.01 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.13 0 CA-C-N 119.389 0.995 . . . . 0.0 108.629 177.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.65 -20.97 52.88 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 118.64 0.655 . . . . 0.0 112.677 -169.416 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -55.94 -61.64 2.24 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 164.001 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 73.1 mt -63.57 -37.44 87.33 Favored 'General case' 0 C--O 1.232 0.141 0 C-N-CA 122.725 0.41 . . . . 0.0 110.699 -175.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -64.34 -17.6 63.86 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -176.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -100.38 -5.66 26.91 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.735 1.214 . . . . 0.0 113.462 -179.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 62.7 mt -67.57 -39.42 84.9 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.58 0.627 . . . . 0.0 110.479 173.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -74.86 169.26 18.28 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 126.434 1.894 . . . . 0.0 109.945 170.323 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.052 0 CA-C-O 117.688 -1.618 . . . . 0.0 112.371 166.704 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 ptp . . . . . 0 N--CA 1.473 0.695 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -113.25 132.1 10.44 Favored Glycine 0 CA--C 1.523 0.571 0 C-N-CA 125.68 1.61 . . . . 0.0 109.773 179.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -165.93 158.51 14.9 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 128.51 2.724 . . . . 0.0 106.194 175.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 146.05 -72.48 0.33 Allowed Glycine 0 CA--C 1.522 0.52 0 CA-C-O 119.015 -0.881 . . . . 0.0 112.206 -173.196 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -122.96 17.21 10.1 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.691 1.596 . . . . 0.0 111.308 -173.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -52.37 144.88 21.49 Favored Pre-proline 0 CA--C 1.536 0.425 0 C-N-CA 126.085 1.754 . . . . 0.0 109.297 172.458 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -64.59 -31.88 59.34 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 121.76 1.64 . . . . 0.0 111.512 -177.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . 0.545 ' HD1' ' HB2' ' A' ' 10' ' ' GLN . 4.1 t-80 -160.58 156.42 22.27 Favored Pre-proline 0 CA--C 1.538 0.503 0 CA-C-O 117.537 -1.22 . . . . 0.0 108.916 178.269 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -83.71 -25.14 2.56 Favored 'Trans proline' 0 CA--C 1.536 0.59 0 C-N-CA 122.566 2.178 . . . . 0.0 112.959 171.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.545 ' HB2' ' HD1' ' A' ' 8' ' ' HIS . 7.4 mm100 -64.84 -18.71 65.37 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.55 1.068 . . . . 0.0 111.703 170.445 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 tt -77.81 123.24 26.48 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.161 0.984 . . . . 0.0 109.18 175.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.408 ' CG1' HD22 ' A' ' 55' ' ' ASN . 48.1 mm -123.59 108.57 21.2 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 N-CA-C 106.625 -1.62 . . . . 0.0 106.625 -179.451 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 82.6 m95 -53.83 155.49 5.94 Favored Pre-proline 0 C--O 1.237 0.431 0 C-N-CA 124.983 1.313 . . . . 0.0 113.427 -177.158 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -68.42 169.37 57.24 Favored 'Cis proline' 0 CA--C 1.534 0.493 0 N-CA-C 113.965 0.717 . . . . 0.0 113.965 -2.348 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -137.21 168.39 19.71 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 123.846 0.858 . . . . 0.0 110.79 177.216 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 14.3 mt -136.73 108.91 7.24 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 126.805 2.042 . . . . 0.0 107.242 -175.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.7 tp -81.01 144.36 31.84 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.633 -0.876 . . . . 0.0 108.633 174.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.15 94.06 2.41 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-N 118.571 0.623 . . . . 0.0 109.77 168.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -57.09 149.89 18.41 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 121.246 0.546 . . . . 0.0 110.328 -179.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -64.08 -10.04 19.94 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 171.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -109.06 0.5 31.52 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 125.831 1.681 . . . . 0.0 114.299 -175.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -142.82 178.41 7.67 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 120.176 1.988 . . . . 0.0 110.944 177.836 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -121.66 -14.07 8.22 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 124.761 1.225 . . . . 0.0 109.163 176.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -65.71 117.16 7.74 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 107.467 -1.308 . . . . 0.0 107.467 175.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.444 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 3.6 mm? -74.41 136.83 42.39 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 106.897 -1.52 . . . . 0.0 106.897 168.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -110.34 87.03 5.8 Favored Pre-proline 0 C--O 1.237 0.399 0 C-N-CA 125.704 1.602 . . . . 0.0 108.491 -173.131 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -65.31 136.65 48.14 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 123.454 2.769 . . . . 0.0 110.049 -178.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.5 mt -132.93 98.26 4.25 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 -178.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.9 mmt85 -50.96 -44.11 60.51 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.487 1.515 . . . . 0.0 111.317 -177.095 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 14.4 t -160.9 -177.59 6.24 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 121.444 0.64 . . . . 0.0 109.385 -177.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -50.38 -38.83 44.66 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 125.537 1.535 . . . . 0.0 110.886 175.644 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -62.35 -33.02 73.9 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.941 0.897 . . . . 0.0 112.243 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.12 -40.15 75.04 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 121.393 -0.817 . . . . 0.0 109.607 174.509 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 47.6 t-105 -63.39 -34.03 76.84 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.214 0.606 . . . . 0.0 111.303 175.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -59.63 -62.24 2.03 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 169.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 13.2 mtt85 -63.27 -14.4 49.01 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 124.138 0.975 . . . . 0.0 113.548 -174.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -64.34 -76.1 0.07 Allowed 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 119.787 1.176 . . . . 0.0 108.608 174.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 1.5 m -61.64 -32.22 72.36 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 118.003 0.365 . . . . 0.0 111.443 -178.238 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.28 -4.76 35.17 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-O 116.661 -1.638 . . . . 0.0 112.243 179.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -136.24 -10.49 1.96 Allowed 'General case' 0 C--N 1.347 0.46 0 N-CA-C 116.743 2.127 . . . . 0.0 116.743 173.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 5.7 m -148.18 105.05 3.59 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 127.775 2.43 . . . . 0.0 107.139 169.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 2.1 pttt -75.51 59.7 1.13 Allowed 'General case' 0 C--O 1.232 0.154 0 C-N-CA 125.072 1.349 . . . . 0.0 108.438 173.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -52.24 148.21 6.77 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 126.341 1.856 . . . . 0.0 108.507 179.215 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.8 tt -61.23 127.66 32.62 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 106.328 -1.731 . . . . 0.0 106.328 173.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.4 mt -114.18 137.69 51.42 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 178.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 -143.54 151.57 40.39 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 124.259 1.024 . . . . 0.0 111.276 -167.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -63.81 115.94 5.29 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 168.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 118.93 -0.17 14.95 Favored Glycine 0 CA--C 1.527 0.835 0 CA-C-O 118.71 -1.05 . . . . 0.0 113.136 -173.027 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -65.32 -20.62 66.49 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 115.627 1.714 . . . . 0.0 115.627 -164.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 10.5 ttmt 44.49 137.08 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 131.385 3.874 . . . . 0.0 117.26 178.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 14.3 mt -125.65 161.94 26.12 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 114.804 -1.089 . . . . 0.0 109.392 167.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 95.2 t -132.38 151.78 35.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 105.533 -2.025 . . . . 0.0 105.533 158.319 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -125.51 -179.47 4.64 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 126.201 1.8 . . . . 0.0 110.828 179.079 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.3 m -64.69 -17.2 63.88 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 178.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.408 HD22 ' CG1' ' A' ' 12' ' ' ILE . 72.3 m-80 -77.03 -10.71 59.55 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 117.995 -1.002 . . . . 0.0 111.964 171.053 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 64.76 21.55 12.4 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 125.657 1.583 . . . . 0.0 111.658 -167.437 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 52.3 m170 -74.53 110.32 8.73 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 106.435 -1.691 . . . . 0.0 106.435 167.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 58.6 m -71.79 151.81 43.2 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 165.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 46.1 m-85 -143.33 160.67 40.1 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 126.461 1.905 . . . . 0.0 108.076 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 2.2 p -154.92 152.34 9.43 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.341 0 CA-C-N 120.741 1.609 . . . . 0.0 111.372 169.481 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 17.1 tp -77.98 144.01 37.11 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 125.396 1.478 . . . . 0.0 108.215 -179.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -120.67 168.19 11.66 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 125.559 1.544 . . . . 0.0 110.062 -172.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -59.64 -31.15 69.25 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 125.321 1.449 . . . . 0.0 110.841 178.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.2 2.87 11.95 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 123.619 0.767 . . . . 0.0 112.473 175.028 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 55.51 18.77 2.84 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 128.937 2.895 . . . . 0.0 113.755 176.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -84.82 -177.16 6.51 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 124.659 1.184 . . . . 0.0 108.549 154.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 50.6 m95 -112.31 154.54 25.54 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 171.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -124.7 150.85 66.68 Favored Pre-proline 0 C--O 1.236 0.374 0 C-N-CA 124.925 1.29 . . . . 0.0 110.221 175.686 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -71.24 111.79 3.17 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 123.75 2.967 . . . . 0.0 109.99 176.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.46 34.87 0.33 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.685 1.194 . . . . 0.0 110.807 171.326 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.83 166.64 0.12 Allowed Pre-proline 0 CA--C 1.545 0.785 0 C-N-CA 125.927 1.691 . . . . 0.0 112.131 -179.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -70.57 176.22 7.69 Favored 'Trans proline' 0 CA--C 1.535 0.571 0 C-N-CA 121.219 1.279 . . . . 0.0 111.076 166.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 20.6 tp -131.43 144.58 54.01 Favored Pre-proline 0 CA--C 1.536 0.441 0 C-N-CA 125.616 1.566 . . . . 0.0 109.324 -174.053 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -77.14 168.19 23.64 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 122.416 2.078 . . . . 0.0 109.555 176.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -59.05 -47.08 19.05 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 122.275 1.983 . . . . 0.0 112.367 178.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -79.16 -6.08 55.71 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 119.482 1.037 . . . . 0.0 110.108 -177.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.6 -24.45 67.92 Favored Glycine 0 CA--C 1.534 1.243 0 CA-C-O 118.841 -0.977 . . . . 0.0 112.972 164.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 25.6 tp -59.2 -48.08 82.94 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.588 1.694 . . . . 0.0 108.916 178.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -67.51 -7.5 26.3 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 125.421 1.488 . . . . 0.0 112.34 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -82.69 -34.94 27.2 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 121.148 1.795 . . . . 0.0 111.251 168.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -66.96 -70.76 0.23 Allowed 'General case' 0 N--CA 1.457 -0.114 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 178.19 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 34.0 mm -57.53 -21.03 15.02 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 C-N-CA 123.102 0.561 . . . . 0.0 112.219 -174.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.87 -47.84 11.13 Favored 'General case' 0 C--N 1.343 0.286 0 C-N-CA 124.3 1.04 . . . . 0.0 111.716 172.159 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.79 -48.85 70.38 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.23 0.612 . . . . 0.0 109.952 -171.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.444 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 10.5 t60 -55.31 -49.32 72.46 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 126.036 1.734 . . . . 0.0 110.01 175.713 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 90.0 m -61.64 -46.41 89.89 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.463 179.063 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.55 -40.4 94.56 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 118.877 0.762 . . . . 0.0 112.33 -178.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.4 t -78.59 7.0 7.46 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.025 0.53 . . . . 0.0 111.753 178.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.5 mt -126.83 -21.99 3.94 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.005 -1.059 . . . . 0.0 111.35 173.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 97.9 6.8 56.91 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 126.378 1.942 . . . . 0.0 113.997 -176.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 81.3 m-70 -76.96 163.15 26.98 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-N 119.404 1.602 . . . . 0.0 110.71 -174.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 42.5 t -157.09 97.83 1.69 Allowed 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.653 1.181 . . . . 0.0 108.053 171.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 27.1 p 46.91 -167.83 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.246 1.819 . . . . 0.0 114.4 175.673 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.444 HG21 ' H ' ' A' ' 95' ' ' SER . 1.2 t -167.61 -85.36 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 105.299 -2.112 . . . . 0.0 105.299 -177.631 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' SER . . . . . 0.444 ' H ' HG21 ' A' ' 94' ' ' THR . 2.5 m -93.06 172.36 8.36 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.587 1.155 . . . . 0.0 109.987 168.661 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . 0.43 0.0 OUTLIER 45.27 -164.91 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 128.62 2.768 . . . . 0.0 114.846 169.075 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -72.63 55.79 0.37 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 127.057 2.143 . . . . 0.0 109.167 176.3 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER 65.2 -54.1 0.33 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 127.778 2.431 . . . . 0.0 112.705 -165.684 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 95.0 mt -145.39 171.44 14.61 Favored 'General case' 0 C--O 1.225 -0.184 0 C-N-CA 127.478 2.311 . . . . 0.0 108.503 -166.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 27.2 t-80 -131.06 -29.56 1.84 Allowed 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 125.066 1.346 . . . . 0.0 110.135 -172.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 5.1 m -173.45 170.53 4.15 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.731 1.612 . . . . 0.0 108.681 -175.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 70.5 t -59.62 -44.0 92.39 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 172.149 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 3.4 tpt -47.34 -54.35 11.32 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.12 0.968 . . . . 0.0 109.377 174.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.63 -29.56 70.78 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.536 0.734 . . . . 0.0 112.184 -175.572 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -69.61 -48.67 59.29 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.553 1.141 . . . . 0.0 110.417 175.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 11.5 mm -59.74 -32.66 50.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 123.99 0.916 . . . . 0.0 109.723 178.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -69.0 -50.15 51.44 Favored 'General case' 0 C--N 1.338 0.091 0 C-N-CA 123.501 0.72 . . . . 0.0 110.437 175.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -54.84 -60.81 2.86 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 125.92 1.688 . . . . 0.0 111.105 178.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.8 mp -52.24 -40.92 62.29 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.412 1.085 . . . . 0.0 112.627 -179.242 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 20.5 m-80 -72.45 -28.54 63.0 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 118.881 0.764 . . . . 0.0 112.718 176.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -76.95 -27.53 54.85 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 121.353 -0.842 . . . . 0.0 111.296 177.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 40.5 mt -64.79 -53.43 47.06 Favored 'General case' 0 CA--C 1.522 -0.107 0 C-N-CA 123.656 0.782 . . . . 0.0 109.401 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.28 136.57 57.37 Favored 'General case' 0 C--O 1.242 0.688 0 CA-C-O 121.765 0.793 . . . . 0.0 110.706 -176.84 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.934 0 CA-C-O 116.184 -2.453 . . . . 0.0 109.881 168.618 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.472 0.629 0 CA-C-O 118.6 -0.714 . . . . 0.0 112.55 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -172.83 -171.56 37.7 Favored Glycine 0 C--N 1.337 0.603 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 176.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -78.43 72.67 4.97 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.816 0.846 . . . . 0.0 108.752 170.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -133.05 -168.3 11.91 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 125.667 1.604 . . . . 0.0 110.465 -179.016 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -124.24 84.73 2.31 Favored 'General case' 0 CA--C 1.528 0.135 0 CA-C-O 122.252 1.025 . . . . 0.0 108.594 179.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.43 144.29 35.5 Favored Pre-proline 0 C--O 1.24 0.577 0 C-N-CA 127.32 2.248 . . . . 0.0 109.863 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -65.59 -47.42 4.11 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 122.262 1.975 . . . . 0.0 111.881 -177.704 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -146.58 145.94 25.15 Favored Pre-proline 0 C--O 1.234 0.281 0 N-CA-C 106.745 -1.576 . . . . 0.0 106.745 170.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -73.96 -34.6 5.01 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.15 1.9 . . . . 0.0 111.348 175.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -76.29 -7.75 55.6 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.994 1.317 . . . . 0.0 113.062 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.1 tt -60.05 107.73 0.67 Allowed 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.236 1.015 . . . . 0.0 108.742 170.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 33.3 mm -83.9 100.2 7.13 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 172.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 64.5 m95 -56.14 155.31 12.82 Favored Pre-proline 0 CA--C 1.544 0.72 0 O-C-N 121.486 -0.759 . . . . 0.0 111.696 178.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -67.79 169.34 53.82 Favored 'Cis proline' 0 N--CA 1.459 -0.544 0 C-N-CA 125.425 -0.656 . . . . 0.0 113.468 -4.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -135.64 170.24 16.28 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.515 0.726 . . . . 0.0 111.059 176.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 mt -136.96 106.9 6.27 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 126.951 2.1 . . . . 0.0 106.203 178.618 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.3 tp -70.26 146.87 50.34 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 105.597 -2.001 . . . . 0.0 105.597 161.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.27 88.48 2.02 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 173.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -61.41 158.11 15.38 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 123.1 1.428 . . . . 0.0 112.417 -158.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.27 134.93 40.98 Favored 'General case' 0 N--CA 1.431 -1.416 0 N-CA-C 105.598 -2.001 . . . . 0.0 105.598 178.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 88.69 -54.79 4.11 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 125.162 1.363 . . . . 0.0 111.137 -175.046 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.436 ' C ' ' H ' ' A' ' 24' ' ' GLU . 0.9 OUTLIER -80.09 -13.65 59.12 Favored 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 115.327 1.603 . . . . 0.0 115.327 -159.521 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.5 m-80 64.47 -20.18 0.07 Allowed 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 121.664 2.029 . . . . 0.0 114.298 175.33 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.436 ' H ' ' C ' ' A' ' 22' ' ' CYS . 28.8 tt0 -73.48 154.81 39.76 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 127.665 2.386 . . . . 0.0 109.525 178.757 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.9 mt -104.17 155.23 18.89 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 125.262 1.425 . . . . 0.0 109.147 -178.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -124.5 86.36 55.31 Favored Pre-proline 0 CA--C 1.538 0.506 0 C-N-CA 124.997 1.319 . . . . 0.0 108.975 177.014 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -68.68 114.82 3.65 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 124.509 3.473 . . . . 0.0 111.512 -177.667 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.8 mt -116.62 104.9 11.85 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 124.997 1.319 . . . . 0.0 108.447 -173.143 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -58.57 -44.7 89.85 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.22 0.533 . . . . 0.0 111.737 -177.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.3 p -151.44 174.47 13.33 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 124.878 1.271 . . . . 0.0 108.937 -162.301 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -69.38 -27.76 65.6 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 119.921 -0.712 . . . . 0.0 111.604 174.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -56.55 -32.8 65.49 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.298 0.954 . . . . 0.0 110.131 169.048 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -68.27 -42.98 78.79 Favored 'General case' 0 C--O 1.223 -0.302 0 O-C-N 120.988 -1.07 . . . . 0.0 110.05 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 31.3 t-105 -59.53 -32.19 70.08 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.514 -0.741 . . . . 0.0 112.02 174.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -65.12 -56.44 12.94 Favored 'General case' 0 CA--C 1.52 -0.178 0 O-C-N 121.067 -1.021 . . . . 0.0 109.057 175.202 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 87.3 mtm180 -57.14 -43.1 82.11 Favored 'General case' 0 C--O 1.221 -0.414 0 C-N-CA 124.073 0.949 . . . . 0.0 110.259 -179.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -50.26 -49.92 51.75 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 124.995 1.318 . . . . 0.0 112.38 174.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 8.9 t -74.27 -27.23 60.64 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 118.882 0.765 . . . . 0.0 111.527 -178.341 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.11 -41.72 70.22 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 118.686 0.676 . . . . 0.0 111.634 174.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -124.18 1.45 8.51 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -154.906 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 43.9 t -133.95 -72.08 0.5 Allowed 'General case' 0 C--O 1.234 0.26 0 C-N-CA 124.184 0.994 . . . . 0.0 108.756 174.428 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.7 ptmt 44.2 45.11 6.91 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 125.898 1.679 . . . . 0.0 113.254 177.096 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -68.76 66.26 0.13 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.669 1.988 . . . . 0.0 109.468 169.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.3 mp 49.61 -176.58 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 127.016 2.127 . . . . 0.0 112.977 -176.404 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 67.5 mt -143.03 127.08 17.39 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 106.375 -1.713 . . . . 0.0 106.375 161.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 -109.52 149.11 30.1 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 172.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -70.16 70.62 0.39 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 126.674 1.99 . . . . 0.0 110.016 -178.181 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 160.76 2.97 0.06 OUTLIER Glycine 0 N--CA 1.439 -1.108 0 C-N-CA 123.553 0.597 . . . . 0.0 112.003 -172.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -65.35 -10.2 31.07 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 -172.412 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.7 ttmt 60.05 140.75 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 129.228 3.011 . . . . 0.0 111.997 174.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 5.7 mt -130.73 154.77 47.61 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 106.538 -1.653 . . . . 0.0 106.538 167.318 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 53.2 t -136.79 122.33 27.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 102.687 -3.079 . . . . 0.0 102.687 173.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -82.03 -165.54 1.02 Allowed 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 127.965 2.506 . . . . 0.0 112.486 167.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 83.6 p -73.06 -29.86 63.28 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 120.254 1.388 . . . . 0.0 114.043 176.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -83.18 1.47 40.44 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 126.224 1.81 . . . . 0.0 111.259 -168.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 65.46 22.7 11.89 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.615 1.966 . . . . 0.0 111.364 -173.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -66.76 112.49 4.26 Favored 'General case' 0 C--O 1.232 0.152 0 O-C-N 120.381 -1.449 . . . . 0.0 109.934 161.213 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 11.4 m -69.35 158.28 35.38 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 119.956 -0.698 . . . . 0.0 109.36 161.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -141.75 166.1 25.65 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 125.518 1.527 . . . . 0.0 109.445 172.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 34.1 t -144.46 134.44 19.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 C-N-CA 127.141 2.176 . . . . 0.0 107.209 177.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.79 135.6 37.13 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 106.605 -1.628 . . . . 0.0 106.605 167.056 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -120.02 170.61 9.12 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 119.751 1.159 . . . . 0.0 111.92 174.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -54.91 -17.29 3.48 Favored 'General case' 0 N--CA 1.468 0.467 0 O-C-N 121.034 -1.041 . . . . 0.0 112.865 175.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -72.51 -5.29 35.94 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.551 1.14 . . . . 0.0 113.592 173.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 68.89 6.78 5.79 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 126.683 1.993 . . . . 0.0 112.574 -176.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -95.12 162.47 13.7 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 119.396 0.998 . . . . 0.0 111.667 171.648 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 56.5 m95 -107.51 78.7 1.23 Allowed 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 124.979 1.312 . . . . 0.0 108.59 178.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 63.0 t-80 -60.7 144.09 89.92 Favored Pre-proline 0 CA--C 1.545 0.75 0 CA-C-O 119.136 -0.459 . . . . 0.0 110.187 -171.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.82 113.23 3.48 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 124.103 3.202 . . . . 0.0 111.097 173.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -94.13 40.43 1.08 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.857 1.663 . . . . 0.0 111.24 -179.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.91 165.25 0.13 Allowed Pre-proline 0 CA--C 1.543 0.677 0 C-N-CA 127.856 2.462 . . . . 0.0 113.485 175.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -68.16 171.21 12.99 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.726 2.284 . . . . 0.0 112.025 167.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.0 tp -146.95 146.15 24.96 Favored Pre-proline 0 CA--C 1.534 0.335 0 C-N-CA 124.121 0.968 . . . . 0.0 111.41 -170.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -64.75 164.47 24.1 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 123.138 2.558 . . . . 0.0 113.384 171.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -61.17 -28.75 85.74 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 123.806 3.004 . . . . 0.0 112.809 174.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -82.51 -16.99 46.69 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 121.803 -0.561 . . . . 0.0 110.941 -179.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.93 -32.18 80.21 Favored Glycine 0 CA--C 1.534 1.263 0 N-CA-C 110.926 -0.87 . . . . 0.0 110.926 177.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 23.0 tp -58.71 -52.61 64.94 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.001 -1.293 . . . . 0.0 110.059 169.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -52.39 -27.33 15.3 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.885 0.874 . . . . 0.0 113.04 -174.128 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -72.07 -42.13 66.58 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.01 0.924 . . . . 0.0 112.171 178.242 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.5 mp -61.8 -44.83 96.08 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 123.909 0.884 . . . . 0.0 110.696 173.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 49.4 mm -55.83 -50.09 70.6 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 C-N-CA 123.713 0.805 . . . . 0.0 108.949 175.429 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.97 -46.19 10.96 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 125.475 1.51 . . . . 0.0 112.448 174.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -58.49 -51.4 70.02 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 123.457 0.473 . . . . 0.0 111.049 -177.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 26.5 t60 -61.24 -46.27 91.09 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.469 1.108 . . . . 0.0 110.508 177.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 73.1 m -60.97 -46.31 91.26 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 117.54 -1.219 . . . . 0.0 110.341 -178.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.84 -31.11 68.8 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 119.851 1.205 . . . . 0.0 112.22 -176.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 15.3 t -73.25 -5.88 42.32 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 117.727 -1.13 . . . . 0.0 111.878 176.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 90.0 mt -123.51 -62.33 1.32 Allowed 'General case' 0 C--N 1.342 0.267 0 CA-C-N 120.039 1.29 . . . . 0.0 110.405 -176.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 153.61 7.22 0.09 OUTLIER Glycine 0 CA--C 1.537 1.439 0 C-N-CA 126.907 2.194 . . . . 0.0 113.224 176.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 15.5 m170 -74.47 151.16 39.61 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 118.645 1.222 . . . . 0.0 109.468 -160.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 2.7 p -143.19 26.24 1.67 Allowed 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -161.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 1.7 p 57.43 -174.76 0.07 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 127.251 2.22 . . . . 0.0 109.356 -167.245 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 3.1 t -157.21 -47.49 0.07 Allowed 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 175.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.4 p -135.12 161.96 33.85 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 119.547 1.067 . . . . 0.0 109.776 173.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 57.28 -167.92 0.12 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.285 1.034 . . . . 0.0 111.631 173.232 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 33.6 ttp -80.02 62.07 4.1 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.498 1.119 . . . . 0.0 109.305 177.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 3.5 m80 61.69 -71.88 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.518 1.527 . . . . 0.0 110.006 -161.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 81.4 mt -137.28 158.76 43.71 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 125.895 1.678 . . . . 0.0 110.277 -160.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -120.22 -20.97 7.14 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 124.062 0.945 . . . . 0.0 110.744 -163.036 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 17.2 m -160.1 173.92 15.08 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 127.177 2.191 . . . . 0.0 108.2 170.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 41.0 t -61.11 -40.58 86.23 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.307 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 168.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 4.1 ttm -60.79 -41.67 96.04 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 118.513 0.597 . . . . 0.0 110.794 -178.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -58.22 -35.03 71.07 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-O 119.187 -0.435 . . . . 0.0 110.869 174.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.18 -39.97 93.61 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 118.721 0.691 . . . . 0.0 111.545 179.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.7 mm -59.92 -51.62 70.74 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 177.193 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -62.89 -49.26 75.52 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.366 1.066 . . . . 0.0 109.795 -176.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -55.26 -52.57 62.97 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 126.621 1.968 . . . . 0.0 111.784 179.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 41.2 mt -62.22 -37.78 86.66 Favored 'General case' 0 CA--C 1.523 -0.088 0 CA-C-N 117.679 0.218 . . . . 0.0 110.8 -172.284 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -78.38 -26.36 46.53 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 122.569 0.348 . . . . 0.0 111.38 177.026 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -74.64 -25.83 59.47 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 118.628 -0.701 . . . . 0.0 112.413 174.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 13.1 mt -66.34 -48.48 70.1 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 118.931 0.787 . . . . 0.0 110.304 177.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -66.71 143.44 56.96 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 122.49 0.316 . . . . 0.0 110.169 -178.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.71 0 N-CA-C 106.777 -2.529 . . . . 0.0 106.777 -173.548 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 44.1 p . . . . . 0 CA--C 1.537 0.449 0 N-CA-C 111.574 0.213 . . . . 0.0 111.574 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -74.11 -55.1 0.09 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.113 0 C-N-CA 120.682 0.921 . . . . 0.0 110.761 -174.318 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -156.09 144.58 14.58 Favored Pre-proline 0 C--O 1.237 0.414 0 N-CA-C 106.091 -1.818 . . . . 0.0 106.091 -179.084 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -69.57 -29.52 24.66 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.053 1.835 . . . . 0.0 110.78 174.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -82.38 -15.53 52.39 Favored 'General case' 0 N--CA 1.455 -0.2 0 O-C-N 121.916 -0.49 . . . . 0.0 112.277 -171.764 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.6 tt -63.0 122.46 16.1 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 170.486 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 21.0 mm -103.09 109.25 26.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 N-CA-C 107.167 -1.42 . . . . 0.0 107.167 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.538 ' HE1' HD21 ' A' ' 31' ' ' ASN . 85.6 m95 -58.81 156.35 25.52 Favored Pre-proline 0 CA--C 1.542 0.644 0 C-N-CA 124.134 0.974 . . . . 0.0 111.079 179.471 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -66.92 170.26 45.43 Favored 'Cis proline' 0 N--CA 1.458 -0.604 0 C-N-CA 125.303 -0.707 . . . . 0.0 113.38 -4.358 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -136.5 168.75 18.88 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.591 0.71 . . . . 0.0 110.678 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 18.9 mt -136.01 103.57 5.4 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 125.826 1.651 . . . . 0.0 108.027 -174.084 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.5 tp -87.35 143.44 27.25 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 174.466 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.413 ' HG2' HD22 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -138.11 83.31 1.97 Allowed 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 119.992 1.269 . . . . 0.0 110.373 179.092 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -59.7 155.27 16.15 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 123.439 0.695 . . . . 0.0 111.714 -161.118 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.13 139.92 58.74 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-O 123.317 1.532 . . . . 0.0 108.694 -176.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 69.12 -33.65 0.31 Allowed Glycine 0 CA--C 1.533 1.177 0 C-N-CA 127.487 2.47 . . . . 0.0 113.805 -175.131 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 89.8 m -76.18 176.31 8.17 Favored 'General case' 0 C--O 1.24 0.59 0 CA-C-N 120.755 2.277 . . . . 0.0 111.03 177.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.5 m-80 -128.46 -22.52 3.34 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 124.858 1.263 . . . . 0.0 111.465 -176.287 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -66.37 111.08 3.34 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 107.929 -1.138 . . . . 0.0 107.929 -176.604 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.604 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 3.2 mm? -60.09 139.14 57.67 Favored 'General case' 0 CA--C 1.512 -0.506 0 N-CA-C 107.208 -1.405 . . . . 0.0 107.208 167.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.421 HD13 ' HA ' ' A' ' 26' ' ' LEU . 0.4 OUTLIER -103.85 87.46 1.53 Allowed Pre-proline 0 C--N 1.324 -0.506 0 N-CA-C 104.579 -2.378 . . . . 0.0 104.579 176.567 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -62.54 140.95 84.42 Favored 'Trans proline' 0 N--CA 1.452 -0.956 0 N-CA-C 108.147 -1.521 . . . . 0.0 108.147 170.725 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.8 mt -138.5 100.29 4.06 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 104.614 -2.365 . . . . 0.0 104.614 -177.071 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 63.8 mtt180 -59.09 -35.93 74.24 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 118.352 0.524 . . . . 0.0 111.206 -175.038 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 15.0 t -161.66 -178.93 6.88 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 123.628 0.771 . . . . 0.0 109.018 -175.555 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.538 HD21 ' HE1' ' A' ' 13' ' ' TRP . 4.5 t-20 -57.84 -28.36 64.03 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 125.497 1.519 . . . . 0.0 112.587 -179.33 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -61.52 -41.16 96.92 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.702 -0.624 . . . . 0.0 109.981 176.126 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -66.34 -30.84 71.32 Favored 'General case' 0 CA--C 1.522 -0.117 0 C-N-CA 123.783 0.833 . . . . 0.0 110.925 -175.77 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 63.5 t-105 -74.48 -43.09 57.64 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.671 0.788 . . . . 0.0 111.061 173.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -63.3 -35.44 80.38 Favored 'General case' 0 CA--C 1.528 0.13 0 O-C-N 121.698 -0.627 . . . . 0.0 110.283 176.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 63.2 mtt180 . . . . . 0 CA--C 1.538 0.495 0 C-N-CA 124.511 1.124 . . . . 0.0 112.357 173.204 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.8 mt . . . . . 0 CA--C 1.511 -0.529 0 CA-C-O 122.823 1.297 . . . . 0.0 109.826 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -88.63 152.0 22.11 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 113.779 -1.555 . . . . 0.0 109.577 -175.419 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.431 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 1.4 m-85 -71.54 93.27 1.19 Allowed 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 173.584 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 141.85 -5.27 2.24 Favored Glycine 0 N--CA 1.443 -0.891 0 CA-C-O 117.824 -1.542 . . . . 0.0 113.816 -163.006 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.55 -7.49 44.25 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 116.684 2.105 . . . . 0.0 116.684 -164.328 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.0 tppt? 44.65 130.89 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 131.405 3.882 . . . . 0.0 116.213 -174.252 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.1 mt -117.52 152.52 34.92 Favored 'General case' 0 C--N 1.331 -0.238 0 O-C-N 120.776 -1.202 . . . . 0.0 107.995 164.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 54.1 t -133.82 141.49 43.92 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 105.817 -1.919 . . . . 0.0 105.817 167.577 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -109.49 174.84 5.68 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 125.489 1.516 . . . . 0.0 110.448 175.313 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.2 m -60.89 -17.11 48.69 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -179.318 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -98.03 11.08 38.75 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.836 1.254 . . . . 0.0 111.308 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 64.54 24.75 13.12 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.023 1.729 . . . . 0.0 111.987 176.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 32.8 m80 -75.65 114.97 14.83 Favored 'General case' 0 C--N 1.332 -0.186 0 O-C-N 120.43 -1.418 . . . . 0.0 107.711 166.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.506 ' SG ' HD13 ' A' ' 73' ' ' LEU . 1.3 m -73.1 153.86 40.63 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 122.129 0.966 . . . . 0.0 108.949 161.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -140.33 157.54 45.39 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 126.359 1.864 . . . . 0.0 106.846 171.491 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 79.0 t -129.0 148.79 33.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 106.155 -1.794 . . . . 0.0 106.155 167.933 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 18.3 tp -86.93 144.14 27.08 Favored 'General case' 0 CA--C 1.521 -0.163 0 C-N-CA 125.925 1.69 . . . . 0.0 109.137 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -116.03 165.19 13.4 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 124.402 1.081 . . . . 0.0 110.359 -175.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.431 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 0.1 OUTLIER -68.18 -14.49 63.02 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 173.798 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -81.02 16.14 1.6 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.581 1.553 . . . . 0.0 111.823 173.486 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 45.78 37.36 3.38 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 126.854 2.062 . . . . 0.0 112.411 -178.804 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.1 p-80 -125.6 170.28 11.64 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 172.322 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 62.4 m95 -111.71 127.57 55.82 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 107.203 -1.406 . . . . 0.0 107.203 175.831 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -97.76 145.79 30.34 Favored Pre-proline 0 CA--C 1.537 0.481 0 C-N-CA 123.975 0.91 . . . . 0.0 108.966 178.201 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.26 116.01 4.52 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 123.376 2.717 . . . . 0.0 110.881 175.664 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -117.87 57.37 0.83 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.863 1.665 . . . . 0.0 109.568 -170.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.11 156.24 0.14 Allowed Pre-proline 0 CA--C 1.538 0.497 0 C-N-CA 129.731 3.213 . . . . 0.0 114.147 178.01 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -72.07 169.85 20.4 Favored 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 121.765 1.643 . . . . 0.0 110.355 161.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.506 HD13 ' SG ' ' A' ' 58' ' ' CYS . 11.3 tp -126.21 144.66 49.82 Favored Pre-proline 0 N--CA 1.451 -0.42 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.922 -167.006 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -69.95 165.28 31.72 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 121.614 1.542 . . . . 0.0 111.52 176.324 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -56.47 -31.11 84.79 Favored 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 123.434 2.756 . . . . 0.0 113.388 174.134 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -81.72 -15.96 52.7 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.278 1.031 . . . . 0.0 112.242 176.333 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -76.75 -22.15 72.83 Favored Glycine 0 CA--C 1.527 0.794 0 O-C-N 121.763 -0.586 . . . . 0.0 112.104 -174.191 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 29.7 tp -63.49 -48.53 77.24 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 121.694 -0.886 . . . . 0.0 109.6 164.229 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -53.86 -37.77 64.0 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 118.695 -0.669 . . . . 0.0 111.479 175.266 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -60.4 -34.38 73.84 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.564 1.075 . . . . 0.0 113.053 177.468 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.9 mp -67.8 -64.07 0.93 Allowed 'General case' 0 N--CA 1.456 -0.127 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 172.688 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.9 mm -60.58 -26.96 39.31 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 C-N-CA 123.681 0.792 . . . . 0.0 111.538 -170.498 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -44.98 -41.62 7.5 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 125.415 1.486 . . . . 0.0 110.905 168.755 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.56 -63.58 1.09 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.771 1.228 . . . . 0.0 111.522 176.323 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.604 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 7.4 t60 -55.77 -40.1 72.15 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.368 1.067 . . . . 0.0 111.267 -177.222 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 23.7 m -68.46 -51.81 39.5 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 120.38 -1.45 . . . . 0.0 110.301 177.326 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.74 -33.24 75.42 Favored 'General case' 0 C--N 1.339 0.137 0 CA-C-N 119.099 0.863 . . . . 0.0 111.887 -175.522 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.3 t -71.13 -28.41 64.27 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 118.403 -0.808 . . . . 0.0 109.302 -176.704 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 98.1 mt -88.4 -56.68 3.21 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 124.478 1.111 . . . . 0.0 110.858 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 142.99 9.45 0.51 Allowed Glycine 0 CA--C 1.532 1.118 0 CA-C-O 117.96 -1.467 . . . . 0.0 114.38 -172.101 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 7.3 m-70 . . . . . 0 N--CA 1.464 0.225 0 CA-C-N 120.456 2.128 . . . . 0.0 111.877 -173.562 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.329 0 CA-C-O 118.901 -0.571 . . . . 0.0 110.276 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 77.7 mt -147.4 134.71 20.64 Favored 'General case' 0 CA--C 1.512 -0.499 0 C-N-CA 124.947 1.299 . . . . 0.0 107.664 -174.259 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 51.9 t-80 -61.92 -48.08 82.05 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 122.04 0.924 . . . . 0.0 110.536 178.551 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 2.8 m -164.82 -178.17 5.11 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.767 1.227 . . . . 0.0 111.296 -169.07 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 63.2 t -64.54 -38.24 82.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 CA-C-O 118.47 -0.776 . . . . 0.0 110.659 -176.277 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.01 -50.44 61.37 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 119.257 0.935 . . . . 0.0 109.122 177.002 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -65.53 -36.29 83.36 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.858 1.263 . . . . 0.0 110.307 -175.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.3 -48.5 81.09 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.999 0.519 . . . . 0.0 110.48 176.261 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 20.2 mm -65.24 -28.35 44.34 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 -178.175 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -69.8 -48.4 59.27 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.198 -0.939 . . . . 0.0 109.415 173.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -57.79 -65.11 0.69 Allowed 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 125.781 1.632 . . . . 0.0 111.629 -179.344 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.4 mp -49.23 -33.95 13.83 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 126.237 1.815 . . . . 0.0 113.914 -175.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -62.18 -44.99 95.38 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 118.141 0.428 . . . . 0.0 112.049 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -82.52 -8.68 59.61 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -173.137 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . 0.275 3.2 tp . . . . . 0 N--CA 1.4 -2.948 0 C-N-CA 128.352 2.661 . . . . 0.0 107.51 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 20.6 p . . . . . 0 CA--C 1.535 0.386 0 CA-C-O 118.773 -0.632 . . . . 0.0 110.775 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.98 -55.48 0.31 Allowed 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 120.928 1.086 . . . . 0.0 111.697 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -160.82 143.78 9.69 Favored Pre-proline 0 CA--C 1.534 0.362 0 CA-C-N 119.485 1.039 . . . . 0.0 110.29 -173.576 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -73.84 -23.49 16.43 Favored 'Trans proline' 0 CA--C 1.531 0.372 0 C-N-CA 121.446 1.431 . . . . 0.0 113.56 -176.265 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 -72.25 -28.74 63.34 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-O 116.899 -1.524 . . . . 0.0 111.974 172.324 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.5 tt -56.33 123.59 15.14 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 120.106 1.321 . . . . 0.0 110.939 -173.449 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 28.0 mm -106.25 97.19 5.31 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.145 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 -177.703 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.48 ' CH2' ' HB2' ' A' ' 34' ' ' TRP . 81.5 m95 -51.16 144.06 15.63 Favored Pre-proline 0 C--O 1.236 0.391 0 O-C-N 123.761 0.663 . . . . 0.0 111.057 174.756 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -75.87 169.71 73.77 Favored 'Cis proline' 0 N--CA 1.458 -0.58 0 N-CA-C 114.142 0.785 . . . . 0.0 114.142 8.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -138.02 171.33 14.57 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 121.282 0.563 . . . . 0.0 111.496 175.432 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 19.3 mt -137.58 109.17 6.99 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 125.966 1.706 . . . . 0.0 108.067 -173.19 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 13.4 tp -94.41 137.79 33.13 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.549 1.139 . . . . 0.0 108.678 175.632 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -130.88 84.89 2.22 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.678 1.126 . . . . 0.0 110.959 179.342 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -46.21 132.43 9.88 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 126.982 2.113 . . . . 0.0 110.004 -175.237 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -60.71 127.68 32.84 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 122.601 1.191 . . . . 0.0 110.117 177.634 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 99.06 -49.53 1.23 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 126.295 1.902 . . . . 0.0 110.106 -174.348 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 57.1 m -67.99 169.26 10.32 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 122.831 1.3 . . . . 0.0 111.11 -178.483 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -129.41 -30.59 2.12 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 125.346 1.459 . . . . 0.0 108.935 -178.094 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -72.83 98.62 2.47 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 126.538 1.935 . . . . 0.0 108.579 -172.265 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.489 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 2.0 mm? -53.87 152.29 5.71 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 123.638 0.775 . . . . 0.0 110.918 -173.365 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -105.54 86.61 1.82 Allowed Pre-proline 0 C--O 1.235 0.306 0 C-N-CA 124.907 1.283 . . . . 0.0 108.197 172.26 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -66.94 142.74 63.51 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 121.832 1.688 . . . . 0.0 109.139 168.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.7 mt -145.86 109.32 4.71 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 -179.452 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.8 mmt85 -60.04 -47.7 84.75 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 123.644 0.777 . . . . 0.0 110.571 -176.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 45.3 p -139.86 174.64 10.31 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 124.135 0.974 . . . . 0.0 109.306 -172.217 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.75 -20.87 66.09 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.96 0.504 . . . . 0.0 111.486 173.535 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 48.1 m-20 -55.52 -42.5 74.62 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 123.794 0.838 . . . . 0.0 108.766 171.267 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -81.75 -29.64 32.77 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 123.14 0.576 . . . . 0.0 111.672 -173.774 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.48 ' HB2' ' CH2' ' A' ' 13' ' ' TRP . 44.7 t-105 -56.88 -45.49 82.49 Favored 'General case' 0 CA--C 1.528 0.129 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 169.537 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 66.2 mm-40 -64.33 -47.65 78.56 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 123.047 0.539 . . . . 0.0 110.367 174.402 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 28.1 mtt180 . . . . . 0 N--CA 1.475 0.806 0 CA-C-O 118.164 -0.922 . . . . 0.0 113.43 178.166 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 85.2 mt . . . . . 0 N--CA 1.451 -0.382 0 N-CA-C 105.244 -2.132 . . . . 0.0 105.244 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -117.12 152.0 35.65 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 125.469 1.508 . . . . 0.0 108.731 -177.811 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.428 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 11.7 m-85 -58.06 138.27 56.17 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 107.092 -1.448 . . . . 0.0 107.092 167.311 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.75 3.18 80.79 Favored Glycine 0 CA--C 1.529 0.962 0 CA-C-O 117.55 -1.694 . . . . 0.0 114.872 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -65.97 -10.66 41.37 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 120.231 2.016 . . . . 0.0 115.154 -170.25 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 53.68 127.92 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 129.67 3.188 . . . . 0.0 115.443 176.86 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 13.0 mt -113.21 157.24 21.98 Favored 'General case' 0 C--N 1.328 -0.363 0 O-C-N 121.007 -1.058 . . . . 0.0 108.45 165.359 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 47.7 t -146.05 138.32 20.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 C-N-CA 128.379 2.672 . . . . 0.0 104.146 177.067 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.8 p-10 -118.15 -179.1 3.67 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 124.725 1.21 . . . . 0.0 111.347 177.663 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.64 -7.7 16.54 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 177.637 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -100.75 5.29 43.57 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.787 1.635 . . . . 0.0 111.54 174.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 59.06 20.27 8.13 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.343 1.457 . . . . 0.0 111.402 -178.102 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 49.5 m170 -72.35 111.77 7.83 Favored 'General case' 0 C--O 1.233 0.232 0 O-C-N 120.283 -1.511 . . . . 0.0 107.789 171.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -78.65 147.78 33.45 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 175.932 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -142.64 143.65 32.45 Favored 'General case' 0 N--CA 1.435 -1.222 0 CA-C-N 113.114 -1.857 . . . . 0.0 107.248 -172.236 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 55.5 t -127.94 146.99 32.66 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 C-N-CA 128.519 2.728 . . . . 0.0 107.128 177.345 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 22.2 tp -87.96 138.76 31.17 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 124.926 1.291 . . . . 0.0 107.618 171.306 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -117.23 169.04 9.78 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 123.666 0.786 . . . . 0.0 111.39 176.608 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.428 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 20.6 mp0 -57.94 -24.67 58.95 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.359 1.464 . . . . 0.0 112.55 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -71.57 -0.51 10.81 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.508 1.123 . . . . 0.0 113.386 178.005 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 66.02 12.16 8.26 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 128.395 2.678 . . . . 0.0 113.883 -178.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.42 ' CD2' ' HD1' ' A' ' 68' ' ' HIS . 1.3 p-80 -99.56 179.95 4.39 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 124.36 1.064 . . . . 0.0 110.517 168.779 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 76.6 m95 -117.47 121.55 41.33 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.49 1.516 . . . . 0.0 107.02 175.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.42 ' HD1' ' CD2' ' A' ' 66' ' ' HIS . 0.2 OUTLIER -110.78 147.71 37.03 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 125.215 1.406 . . . . 0.0 111.804 179.208 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -67.16 145.72 73.83 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.903 2.402 . . . . 0.0 112.73 -170.2 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -138.04 43.78 2.2 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.48 1.112 . . . . 0.0 110.852 -172.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.52 164.6 0.13 Allowed Pre-proline 0 N--CA 1.47 0.575 0 C-N-CA 128.355 2.662 . . . . 0.0 113.779 175.654 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -69.73 168.64 20.93 Favored 'Trans proline' 0 N--CA 1.452 -0.961 0 C-N-CA 121.343 1.362 . . . . 0.0 111.367 167.403 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.3 tt -123.56 143.2 40.96 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 125.105 1.362 . . . . 0.0 108.51 -172.79 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -79.41 163.81 24.36 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.327 2.684 . . . . 0.0 112.178 -173.793 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.3 -7.88 17.09 Favored 'Trans proline' 0 CA--C 1.53 0.295 0 C-N-CA 123.119 2.546 . . . . 0.0 114.741 -178.772 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -106.71 -16.6 14.45 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.968 1.707 . . . . 0.0 112.398 173.439 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -67.03 -29.22 74.29 Favored Glycine 0 CA--C 1.531 1.07 0 CA-C-N 119.886 1.221 . . . . 0.0 112.281 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 30.7 tp -65.32 -50.58 65.12 Favored 'General case' 0 C--N 1.34 0.16 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.383 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -60.94 -30.57 70.3 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 125.57 1.548 . . . . 0.0 110.034 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -65.99 -47.93 72.89 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 119.281 0.946 . . . . 0.0 110.106 174.75 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 23.2 mt -64.61 -51.13 64.25 Favored 'General case' 0 CA--C 1.52 -0.177 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 -179.431 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 14.8 mm -58.77 -31.85 45.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 C-N-CA 123.633 0.773 . . . . 0.0 110.899 179.257 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -51.88 -38.91 57.95 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 119.914 1.233 . . . . 0.0 111.702 174.156 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.26 -57.65 10.38 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 118.811 0.732 . . . . 0.0 111.003 176.557 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.489 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 21.5 t60 -55.42 -46.72 76.66 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.323 1.049 . . . . 0.0 110.038 176.662 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 73.3 m -72.7 -24.22 60.97 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 120.589 -1.319 . . . . 0.0 112.917 -174.101 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -97.3 -8.94 28.55 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.512 1.125 . . . . 0.0 112.902 -177.631 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.5 t -89.71 -20.98 22.95 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 167.646 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 63.8 mt -115.63 -21.61 9.61 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -176.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 101.22 19.74 15.71 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 115.679 1.031 . . . . 0.0 115.679 172.008 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' HIS . . . . . 0.763 ' CD2' HD13 ' A' ' 112' ' ' LEU . 10.4 m-70 . . . . . 0 CA--C 1.533 0.326 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 -158.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.535 0.367 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.52 HD13 ' HB2' ' A' ' 105' ' ' ALA . 81.1 mt -141.27 142.74 33.88 Favored 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -168.245 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 1.4 m170 -75.64 -36.37 60.22 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 125.038 1.461 . . . . 0.0 110.357 -174.712 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.6 p -164.2 -173.93 3.33 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.963 1.305 . . . . 0.0 109.977 169.354 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 87.7 t -60.8 -41.41 88.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 C-N-CA 124.783 1.233 . . . . 0.0 111.059 176.692 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.9 -46.01 78.48 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 119.677 1.126 . . . . 0.0 110.032 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -66.01 -34.26 77.69 Favored 'General case' 0 C--O 1.227 -0.098 0 C-N-CA 123.138 0.575 . . . . 0.0 110.651 178.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.52 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -55.99 -53.04 61.77 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 123.244 0.618 . . . . 0.0 110.551 175.377 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 30.9 mm -60.86 -34.07 57.95 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 C-N-CA 123.275 0.63 . . . . 0.0 109.805 -176.314 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -81.15 -27.35 35.49 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.948 0.722 . . . . 0.0 112.948 178.419 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.431 ' CE2' HD11 ' A' ' 112' ' ' LEU . 29.0 t80 -67.33 -65.43 0.69 Allowed 'General case' 0 C--O 1.224 -0.255 0 C-N-CA 125.299 1.44 . . . . 0.0 107.976 172.813 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.525 ' HA ' HD12 ' A' ' 112' ' ' LEU . 8.9 mp -49.88 -46.18 51.35 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.359 1.464 . . . . 0.0 112.019 -176.915 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -69.52 -19.94 63.71 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 119.171 0.896 . . . . 0.0 113.166 -179.211 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -93.41 -19.34 21.39 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 123.814 0.846 . . . . 0.0 111.541 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.763 HD13 ' CD2' ' A' ' 91' ' ' HIS . 42.1 mt . . . . . 0 N--CA 1.452 -0.362 0 C-N-CA 124.404 1.082 . . . . 0.0 109.771 177.383 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 35.6 p . . . . . 0 C--O 1.242 0.688 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -77.77 76.21 4.41 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 122.569 2.179 . . . . 0.0 110.014 -177.325 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 75.22 144.63 0.11 Allowed Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 128.052 2.541 . . . . 0.0 112.048 -178.622 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -82.79 -25.96 2.69 Favored 'Trans proline' 0 CA--C 1.538 0.682 0 C-N-CA 122.743 2.296 . . . . 0.0 112.836 174.636 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -74.67 -18.06 60.59 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 121.226 -0.921 . . . . 0.0 111.891 176.306 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.7 tt -61.84 115.22 3.84 Favored 'General case' 0 C--N 1.34 0.18 0 N-CA-C 107.175 -1.417 . . . . 0.0 107.175 167.424 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 23.7 mm -98.3 116.05 40.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 N-CA-C 106.71 -1.589 . . . . 0.0 106.71 174.524 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -62.44 154.18 73.46 Favored Pre-proline 0 C--O 1.239 0.551 0 CA-C-O 119.558 -0.258 . . . . 0.0 110.347 175.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -66.92 166.59 61.24 Favored 'Cis proline' 0 N--CA 1.458 -0.602 0 N-CA-C 114.615 0.967 . . . . 0.0 114.615 -0.836 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -131.87 168.09 18.45 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 123.438 0.695 . . . . 0.0 110.732 176.784 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.515 HD22 HD12 ' A' ' 25' ' ' LEU . 12.3 mt -138.93 94.79 2.86 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 126.084 1.754 . . . . 0.0 108.209 -175.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.2 tp -74.59 142.12 44.67 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 171.283 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.43 97.18 3.0 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 174.587 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -56.69 154.59 8.73 Favored 'General case' 0 N--CA 1.444 -0.734 0 O-C-N 124.436 1.085 . . . . 0.0 112.189 -169.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -68.53 124.77 24.5 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 114.672 -1.149 . . . . 0.0 108.61 174.457 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 99.02 -46.84 1.42 Allowed Glycine 0 CA--C 1.518 0.28 0 C-N-CA 125.383 1.468 . . . . 0.0 111.518 178.476 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 76.0 m -76.36 175.16 9.38 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 122.312 1.054 . . . . 0.0 111.231 178.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -125.88 -22.99 4.05 Favored 'General case' 0 C--N 1.334 -0.095 0 C-N-CA 125.164 1.386 . . . . 0.0 110.499 -174.673 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -62.95 121.2 12.96 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 124.732 1.213 . . . . 0.0 108.988 -177.245 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.515 HD12 HD22 ' A' ' 16' ' ' LEU . 3.7 mm? -74.16 150.68 40.3 Favored 'General case' 0 N--CA 1.454 -0.254 0 O-C-N 121.019 -1.051 . . . . 0.0 109.916 172.332 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -111.25 86.87 6.8 Favored Pre-proline 0 CA--C 1.532 0.279 0 C-N-CA 124.689 1.196 . . . . 0.0 108.717 173.185 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -64.39 132.88 35.16 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 121.682 1.588 . . . . 0.0 108.973 174.205 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.8 mt -134.56 101.28 4.9 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 -178.323 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.16 -38.14 87.36 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 118.559 0.618 . . . . 0.0 111.058 -169.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.0 t -151.77 180.0 7.94 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 121.964 0.887 . . . . 0.0 110.418 172.166 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.64 -28.79 68.83 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 125.081 1.352 . . . . 0.0 112.613 -173.414 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -59.5 -39.8 85.01 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.015 0.825 . . . . 0.0 110.439 178.255 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -60.76 -48.58 81.18 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 124.611 1.165 . . . . 0.0 109.692 177.418 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 25.4 t-105 -58.69 -47.96 82.74 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 123.401 0.68 . . . . 0.0 111.322 175.368 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -64.61 -28.34 69.56 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 123.238 0.615 . . . . 0.0 110.982 -176.819 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.9 mtp-105 . . . . . 0 N--CA 1.466 0.372 0 C-N-CA 123.392 0.677 . . . . 0.0 112.034 168.481 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.0 mt . . . . . 0 C--O 1.231 0.13 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -111.56 148.49 33.13 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 124.498 1.119 . . . . 0.0 109.755 -170.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.403 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 13.0 m-85 -57.96 134.84 56.71 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 161.553 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 89.56 3.86 74.11 Favored Glycine 0 CA--C 1.531 1.057 0 CA-C-O 118.526 -1.152 . . . . 0.0 115.256 -177.179 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -70.25 -2.7 14.11 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 120.206 2.003 . . . . 0.0 115.675 -170.274 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.4 ttmm 45.96 117.28 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 130.94 3.696 . . . . 0.0 115.685 170.771 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 12.9 mt -103.35 159.79 15.26 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.324 167.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 91.1 t -137.0 154.91 31.95 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 C-N-CA 127.369 2.267 . . . . 0.0 105.09 163.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -123.69 -177.25 3.68 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.966 2.106 . . . . 0.0 111.496 -178.702 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.71 3.03 4.43 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.796 1.639 . . . . 0.0 113.247 178.246 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -123.55 16.71 9.63 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.696 1.998 . . . . 0.0 111.111 177.001 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 62.74 18.89 11.03 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.904 1.282 . . . . 0.0 111.889 175.513 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -70.87 108.47 4.52 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 119.959 -1.713 . . . . 0.0 108.672 170.25 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 56.5 m -69.49 151.06 46.5 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 119.451 -0.899 . . . . 0.0 108.576 164.521 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -137.37 161.07 37.28 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 125.241 1.416 . . . . 0.0 108.252 169.606 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 25.6 t -134.78 137.67 50.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 C-N-CA 130.288 3.435 . . . . 0.0 106.018 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 16.1 tp -85.84 133.21 33.98 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 170.273 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -110.1 174.31 5.92 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.534 1.134 . . . . 0.0 110.843 176.766 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.403 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 52.6 mt-10 -59.9 -18.61 46.11 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.989 1.716 . . . . 0.0 112.682 176.808 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -76.3 -7.62 55.32 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.167 0.987 . . . . 0.0 112.033 173.254 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 60.3 6.76 1.09 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 128.854 2.861 . . . . 0.0 114.815 -171.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 2.1 p-80 -76.11 161.78 28.56 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 119.641 1.11 . . . . 0.0 110.261 164.148 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 66.1 m95 -103.72 90.77 3.75 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 125.276 1.43 . . . . 0.0 107.943 176.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -78.62 163.41 61.28 Favored Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 124.53 1.132 . . . . 0.0 110.867 179.082 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.64 162.13 40.43 Favored 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.337 2.025 . . . . 0.0 110.595 -176.203 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -150.34 45.08 0.88 Allowed 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.348 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 69.03 165.11 0.13 Allowed Pre-proline 0 C--O 1.239 0.548 0 C-N-CA 127.375 2.27 . . . . 0.0 111.193 -174.193 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -72.82 -175.73 2.02 Favored 'Trans proline' 0 N--CA 1.447 -1.231 0 C-N-CA 121.409 1.406 . . . . 0.0 109.726 162.905 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.403 HD21 ' C ' ' A' ' 77' ' ' GLY . 8.4 tt -129.78 143.41 48.91 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 124.615 1.166 . . . . 0.0 107.935 -174.548 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -81.54 166.41 17.76 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.85 2.367 . . . . 0.0 110.645 -175.066 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -60.5 -26.36 82.63 Favored 'Trans proline' 0 CA--C 1.536 0.599 0 C-N-CA 121.153 1.236 . . . . 0.0 112.588 179.022 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -84.29 -18.0 37.79 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 124.892 1.277 . . . . 0.0 113.078 176.721 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.403 ' C ' HD21 ' A' ' 73' ' ' LEU . . . -72.45 -25.02 75.29 Favored Glycine 0 C--N 1.341 0.83 0 N-CA-C 111.225 -0.75 . . . . 0.0 111.225 -173.863 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 26.8 tp -65.02 -49.63 69.43 Favored 'General case' 0 C--N 1.339 0.131 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 177.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -56.58 -39.34 73.34 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.066 0.947 . . . . 0.0 109.304 173.157 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -65.9 -34.32 77.85 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.696 0.798 . . . . 0.0 112.146 178.612 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.7 mp -62.17 -64.0 1.07 Allowed 'General case' 0 C--N 1.34 0.173 0 O-C-N 121.076 -1.015 . . . . 0.0 109.044 168.424 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.467 HD12 HD11 ' A' ' 109' ' ' LEU . 32.9 mm -60.37 -26.96 38.68 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 123.167 0.587 . . . . 0.0 110.987 -170.38 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.74 -41.08 6.55 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 125.921 1.688 . . . . 0.0 111.714 169.685 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.45 -57.79 7.43 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 118.949 0.795 . . . . 0.0 110.765 -176.562 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.42 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 13.8 t60 -54.62 -48.01 72.73 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.659 1.184 . . . . 0.0 110.112 174.951 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 58.3 m -65.29 -37.01 85.83 Favored 'General case' 0 C--O 1.225 -0.199 0 O-C-N 120.849 -1.157 . . . . 0.0 111.231 -177.46 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -77.95 -16.91 57.78 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 119.154 0.888 . . . . 0.0 112.525 -178.099 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . 0.257 2.0 t -89.53 -30.27 18.34 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 119.51 1.05 . . . . 0.0 110.035 174.478 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 80.0 mt -96.07 -9.69 30.25 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 119.403 1.001 . . . . 0.0 112.966 178.793 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 73.16 28.82 65.57 Favored Glycine 0 CA--C 1.527 0.843 0 C-N-CA 125.453 1.501 . . . . 0.0 113.822 -178.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' HIS . . . . . 0.428 ' ND1' HD13 ' A' ' 112' ' ' LEU . 35.9 m170 . . . . . 0 CA--C 1.539 0.528 0 CA-C-N 118.497 1.149 . . . . 0.0 111.871 -176.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 66.6 m80 . . . . . 0 CA--C 1.532 0.281 0 N-CA-C 111.189 0.07 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.639 HD13 ' HB2' ' A' ' 105' ' ' ALA . 97.8 mt -148.93 134.6 18.75 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.133 0.973 . . . . 0.0 108.883 -152.744 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 41.4 t-80 -69.39 -39.2 78.13 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 120.869 0.366 . . . . 0.0 111.253 178.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 5.2 t -164.29 -174.14 3.39 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.194 1.398 . . . . 0.0 108.895 176.824 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 88.9 t -61.05 -37.68 77.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 C-N-CA 125.622 1.569 . . . . 0.0 111.585 -176.721 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 11.4 ttm -57.56 -48.19 80.0 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 118.933 0.788 . . . . 0.0 110.286 177.262 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -54.34 -41.35 68.99 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 125.704 1.602 . . . . 0.0 110.254 -177.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.639 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -54.47 -47.9 72.41 Favored 'General case' 0 C--O 1.227 -0.113 0 C-N-CA 125.026 1.33 . . . . 0.0 111.766 177.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 38.5 mm -61.73 -43.72 97.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 -176.378 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -68.08 -34.49 76.5 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 118.671 -0.681 . . . . 0.0 111.398 178.414 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.492 ' CE2' HD11 ' A' ' 112' ' ' LEU . 33.0 t80 -60.47 -65.57 0.67 Allowed 'General case' 0 C--O 1.226 -0.133 0 C-N-CA 123.889 0.876 . . . . 0.0 109.433 174.915 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.467 HD11 HD12 ' A' ' 82' ' ' ILE . 8.0 mp -48.16 -49.91 30.77 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 125.246 1.418 . . . . 0.0 111.766 178.194 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 16.7 m-80 -65.54 -31.7 72.89 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 118.781 -0.628 . . . . 0.0 112.358 -178.409 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -75.86 -27.46 57.8 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 117.985 -1.007 . . . . 0.0 111.292 176.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.492 HD11 ' CE2' ' A' ' 108' ' ' PHE . 59.8 mt . . . . . 0 N--CA 1.457 -0.111 0 CA-C-N 119.406 1.003 . . . . 0.0 108.789 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 29.3 p . . . . . 0 N--CA 1.45 -0.452 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -73.49 94.63 0.85 Allowed 'Trans proline' 0 N--CA 1.444 -1.432 0 C-N-CA 121.837 1.691 . . . . 0.0 108.728 174.635 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 75.17 147.27 0.12 Allowed Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 128.35 2.66 . . . . 0.0 111.873 -174.311 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -79.39 -32.35 1.73 Allowed 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 123.264 2.643 . . . . 0.0 112.379 170.868 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -83.87 -6.6 59.46 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.851 1.26 . . . . 0.0 112.764 -176.04 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.44 132.29 49.6 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.838 1.255 . . . . 0.0 108.105 164.552 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.8 mm -115.33 115.83 50.61 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.131 0 C-N-CA 124.823 1.249 . . . . 0.0 107.966 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 71.2 m95 -60.6 151.33 71.44 Favored Pre-proline 0 C--O 1.235 0.296 0 C-N-CA 123.494 0.718 . . . . 0.0 111.725 177.106 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -72.32 174.15 49.54 Favored 'Cis proline' 0 CA--C 1.537 0.65 0 N-CA-C 115.266 1.218 . . . . 0.0 115.266 0.052 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -128.81 166.77 18.39 Favored 'General case' 0 C--N 1.344 0.339 0 C-N-CA 123.39 0.676 . . . . 0.0 112.817 -179.553 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 18.1 mt -139.49 99.63 3.78 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 127.795 2.438 . . . . 0.0 107.937 178.568 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 23.8 tp -70.44 152.95 43.49 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 117.883 -1.056 . . . . 0.0 108.444 169.41 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.424 ' HG2' ' HG ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -144.87 85.95 1.77 Allowed 'General case' 0 C--O 1.234 0.267 0 CA-C-N 120.238 1.381 . . . . 0.0 111.588 170.805 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -44.45 127.28 5.82 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 125.728 1.611 . . . . 0.0 110.517 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.4 tp60 -68.49 90.77 0.39 Allowed 'General case' 0 N--CA 1.432 -1.366 0 C-N-CA 126.036 1.735 . . . . 0.0 111.142 -170.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 115.06 -17.55 17.12 Favored Glycine 0 CA--C 1.524 0.627 0 CA-C-O 118.267 -1.296 . . . . 0.0 112.173 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.422 ' C ' ' H ' ' A' ' 24' ' ' GLU . 3.8 t -71.38 -33.35 69.45 Favored 'General case' 0 C--O 1.22 -0.454 0 CA-C-N 118.881 1.341 . . . . 0.0 109.957 173.909 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.605 ' HB3' ' HB1' ' A' ' 84' ' ' ALA . 7.9 m-80 68.7 -20.83 0.15 Allowed 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.908 1.683 . . . . 0.0 112.552 -172.55 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.422 ' H ' ' C ' ' A' ' 22' ' ' CYS . 23.3 tt0 -64.86 138.26 58.27 Favored 'General case' 0 N--CA 1.441 -0.918 0 C-N-CA 125.308 1.443 . . . . 0.0 108.352 172.865 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.757 HD13 HD13 ' A' ' 82' ' ' ILE . 1.3 mt -96.98 150.6 20.58 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 124.164 0.986 . . . . 0.0 108.519 169.878 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -113.73 87.83 12.85 Favored Pre-proline 0 C--N 1.327 -0.403 0 C-N-CA 124.768 1.227 . . . . 0.0 110.226 175.104 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -64.23 137.43 56.33 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 123.083 2.522 . . . . 0.0 109.994 176.151 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.7 mt -141.47 117.12 10.32 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 106.783 -1.562 . . . . 0.0 106.783 -177.404 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -69.0 -53.59 19.74 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.235 0.541 . . . . 0.0 112.03 -173.172 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 64.3 p -138.85 165.11 27.89 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.983 0.913 . . . . 0.0 108.612 -175.378 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -50.59 -30.85 14.25 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 123.384 0.674 . . . . 0.0 112.652 -177.37 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.9 -42.54 76.15 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.257 1.023 . . . . 0.0 111.595 174.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.44 -47.32 79.53 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 121.216 -0.927 . . . . 0.0 110.484 179.038 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 41.0 t-105 -58.06 -47.04 84.35 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 176.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 -55.09 -58.41 7.76 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.474 0.709 . . . . 0.0 109.444 178.211 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.468 0.439 0 C-N-CA 125.336 1.455 . . . . 0.0 113.587 -178.166 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 85.1 mt . . . . . 0 C--O 1.235 0.299 0 CA-C-O 121.308 0.575 . . . . 0.0 109.637 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -149.85 162.33 40.51 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.616 1.166 . . . . 0.0 109.051 -173.301 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -71.39 105.01 3.37 Favored 'General case' 0 C--O 1.237 0.443 0 O-C-N 121.612 -0.68 . . . . 0.0 109.217 -163.542 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 122.47 5.31 8.61 Favored Glycine 0 CA--C 1.526 0.748 0 CA-C-O 117.433 -1.759 . . . . 0.0 114.787 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.95 -15.58 1.45 Allowed 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 117.255 2.317 . . . . 0.0 117.255 -175.476 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.5 ttmt 44.63 125.67 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.221 1 C-N-CA 132.171 4.188 . . . . 0.0 115.295 -177.005 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.7 mt -109.99 139.42 45.11 Favored 'General case' 0 CA--C 1.512 -0.51 0 O-C-N 120.942 -1.099 . . . . 0.0 108.089 166.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 55.2 t -113.01 151.29 14.92 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 N-CA-C 105.098 -2.186 . . . . 0.0 105.098 162.4 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -131.22 172.19 12.42 Favored 'General case' 0 N--CA 1.437 -1.118 0 C-N-CA 130.294 3.438 . . . . 0.0 108.617 -177.218 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.7 t -56.71 -20.69 23.11 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.36 1.464 . . . . 0.0 113.048 177.564 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -98.35 -0.09 44.43 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.096 1.758 . . . . 0.0 112.619 -169.641 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 59.63 15.3 4.55 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.989 1.716 . . . . 0.0 112.54 -171.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 48.1 m170 -70.18 106.4 3.28 Favored 'General case' 0 CA--C 1.529 0.15 0 O-C-N 120.076 -1.64 . . . . 0.0 109.638 164.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 2.9 t -71.86 151.57 43.3 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 174.701 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -139.1 153.77 48.06 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 124.55 1.14 . . . . 0.0 108.757 176.876 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 27.8 t -141.91 135.41 29.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 C-N-CA 127.526 2.33 . . . . 0.0 107.336 -176.799 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 29.5 tp -80.7 133.44 35.69 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 126.051 1.74 . . . . 0.0 107.719 176.214 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -125.83 170.35 11.71 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.14 0.976 . . . . 0.0 109.441 178.226 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -66.57 -29.3 69.34 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.12 0.968 . . . . 0.0 112.001 -167.547 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -66.73 8.8 0.22 Allowed 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.795 1.238 . . . . 0.0 112.954 171.72 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 63.48 28.25 15.31 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 126.434 1.894 . . . . 0.0 111.674 168.38 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.4 p80 -114.75 166.52 11.66 Favored 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 124.948 1.299 . . . . 0.0 110.191 170.299 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 65.3 m95 -103.71 98.09 8.01 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 126.638 1.975 . . . . 0.0 106.785 174.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 63.3 t-80 -71.08 143.52 88.79 Favored Pre-proline 0 CA--C 1.539 0.55 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 178.17 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -72.08 113.39 3.67 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 123.806 3.004 . . . . 0.0 109.669 172.286 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -91.89 34.54 1.0 Allowed 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.95 1.7 . . . . 0.0 111.99 -173.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.534 ' HB1' ' HD2' ' A' ' 72' ' ' PRO . . . 64.89 166.27 0.12 Allowed Pre-proline 0 CA--C 1.547 0.849 0 C-N-CA 126.684 1.994 . . . . 0.0 111.759 -175.258 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.534 ' HD2' ' HB1' ' A' ' 71' ' ' ALA . 62.0 Cg_endo -67.03 -177.8 1.13 Allowed 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 121.931 1.754 . . . . 0.0 112.626 178.425 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.2 tt -132.61 143.88 50.62 Favored Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 126.053 1.741 . . . . 0.0 108.745 -175.084 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -80.83 164.4 20.41 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 123.005 2.47 . . . . 0.0 111.968 -176.062 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -61.44 -10.87 17.41 Favored 'Trans proline' 0 CA--C 1.528 0.224 0 C-N-CA 123.013 2.475 . . . . 0.0 115.441 178.436 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -106.34 -15.59 14.79 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.043 1.737 . . . . 0.0 113.505 175.792 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.59 -37.99 95.59 Favored Glycine 0 CA--C 1.529 0.93 0 CA-C-N 119.051 0.841 . . . . 0.0 111.301 -177.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.3 tp -52.74 -47.74 67.18 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 125.291 1.436 . . . . 0.0 108.384 177.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -75.64 -17.34 60.02 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 127.625 2.37 . . . . 0.0 110.527 -170.823 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -84.31 -42.39 15.86 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.043 1.337 . . . . 0.0 110.502 170.828 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.5 mp -58.99 -52.74 64.46 Favored 'General case' 0 N--CA 1.46 0.073 0 C-N-CA 123.196 0.598 . . . . 0.0 109.895 176.715 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.757 HD13 HD13 ' A' ' 25' ' ' LEU . 4.1 mm -62.1 -33.51 58.84 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.148 0 C-N-CA 123.675 0.79 . . . . 0.0 110.653 178.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.86 -42.36 58.8 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 121.455 -0.778 . . . . 0.0 110.923 171.302 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.605 ' HB1' ' HB3' ' A' ' 23' ' ' ASN . . . -65.75 -42.64 90.68 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 118.997 -0.525 . . . . 0.0 112.3 -177.942 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.571 ' CB ' HD12 ' A' ' 25' ' ' LEU . 7.8 t60 -60.14 -53.44 57.77 Favored 'General case' 0 C--O 1.222 -0.346 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 172.547 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 94.8 m -57.03 -42.24 80.07 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 121.361 -0.837 . . . . 0.0 110.201 -174.57 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.42 -22.26 66.78 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-O 116.832 -1.556 . . . . 0.0 114.239 -178.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.444 HG23 ' CD2' ' A' ' 89' ' ' LEU 0.377 11.8 t -93.57 -13.39 27.77 Favored 'General case' 0 C--N 1.345 0.403 0 CA-C-N 121.3 1.863 . . . . 0.0 110.925 -177.06 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.444 ' CD2' HG23 ' A' ' 88' ' ' THR . 1.0 OUTLIER -107.85 -14.61 14.74 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 126.322 1.849 . . . . 0.0 111.625 -179.248 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 77.87 15.21 81.49 Favored Glycine 0 CA--C 1.53 0.988 0 CA-C-O 118.416 -1.214 . . . . 0.0 113.27 -172.568 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 24.8 m80 . . . . . 0 C--O 1.235 0.315 0 CA-C-N 119.163 1.482 . . . . 0.0 109.57 -178.003 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 4.6 t-160 . . . . . 0 CA--C 1.546 0.826 0 CA-C-O 117.688 -1.148 . . . . 0.0 109.749 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 93.3 mt -141.63 153.56 44.83 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 121.851 2.114 . . . . 0.0 110.639 174.177 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 23.9 t-80 -75.37 -39.25 59.45 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.716 175.402 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -175.05 178.28 1.79 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 122.948 0.499 . . . . 0.0 111.464 -167.601 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 58.4 t -64.45 -39.47 85.68 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 123.653 0.781 . . . . 0.0 109.892 -176.661 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 3.5 tpt -56.92 -32.1 65.6 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.795 -0.566 . . . . 0.0 111.796 177.697 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -72.2 -48.74 40.8 Favored 'General case' 0 C--O 1.226 -0.176 0 C-N-CA 124.429 1.091 . . . . 0.0 108.221 176.533 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.06 -50.08 67.54 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 125.224 1.41 . . . . 0.0 112.542 -178.362 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 37.6 mm -57.17 -45.81 84.58 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -178.494 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -74.03 -24.73 59.59 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.279 1.032 . . . . 0.0 112.733 -175.532 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -67.26 -70.46 0.25 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.993 0.917 . . . . 0.0 109.088 168.33 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 9.4 mp -51.39 -51.19 56.81 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 127.02 2.128 . . . . 0.0 113.298 -177.614 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -64.23 -12.6 42.39 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 118.186 -0.911 . . . . 0.0 112.28 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -100.85 -7.25 23.74 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 120.105 1.32 . . . . 0.0 112.303 175.052 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 95.8 mt . . . . . 0 C--O 1.235 0.294 0 C-N-CA 124.79 1.236 . . . . 0.0 110.194 173.619 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.235 0.307 0 CA-C-O 118.364 -0.827 . . . . 0.0 109.159 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -69.16 -55.33 0.2 Allowed 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 121.009 1.139 . . . . 0.0 110.555 -167.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' HIS . . . . . 0.409 ' CD2' ' HD2' ' A' ' 9' ' ' PRO . 5.4 t-80 -144.5 148.36 40.0 Favored Pre-proline 0 N--CA 1.451 -0.407 0 C-N-CA 126.614 1.965 . . . . 0.0 106.409 172.726 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.409 ' HD2' ' CD2' ' A' ' 8' ' ' HIS . 51.9 Cg_endo -72.96 -28.98 12.53 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 CA-C-N 120.919 1.364 . . . . 0.0 112.658 179.409 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -80.63 -10.02 59.76 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 118.726 -0.654 . . . . 0.0 112.06 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.5 tt -58.76 132.65 54.54 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 119.084 0.856 . . . . 0.0 109.851 168.411 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.6 mm -113.77 113.01 42.67 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 175.643 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 76.6 m95 -57.8 150.11 49.9 Favored Pre-proline 0 C--O 1.241 0.637 0 C-N-CA 123.255 0.622 . . . . 0.0 111.346 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -71.72 173.22 52.2 Favored 'Cis proline' 0 CA--C 1.54 0.785 0 N-CA-C 114.768 1.026 . . . . 0.0 114.768 0.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -131.17 167.47 19.1 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 124.29 1.036 . . . . 0.0 111.818 176.294 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.402 ' HA ' HD23 ' A' ' 16' ' ' LEU . 27.1 mt -139.54 105.09 5.09 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 126.851 2.061 . . . . 0.0 110.031 -175.269 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.476 HD23 ' CZ3' ' A' ' 34' ' ' TRP . 0.2 OUTLIER -81.56 165.01 21.52 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 123.602 0.761 . . . . 0.0 109.592 168.534 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.451 ' H ' HD13 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -156.64 88.04 1.04 Allowed 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 119.445 -0.312 . . . . 0.0 110.445 163.248 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 22.5 mt-30 -51.6 135.6 28.12 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -166.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -68.26 116.73 9.19 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 -176.68 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 105.3 -2.79 40.19 Favored Glycine 0 CA--C 1.525 0.704 0 CA-C-O 117.398 -1.779 . . . . 0.0 113.615 -173.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.83 172.75 7.94 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 119.956 1.878 . . . . 0.0 109.929 165.677 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.417 ' HB3' ' HB1' ' A' ' 84' ' ' ALA . 8.3 m-80 -110.95 -17.62 13.26 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 125.501 1.52 . . . . 0.0 108.881 177.068 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -76.24 127.98 34.0 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 -177.678 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.42 HD23 ' HB2' ' A' ' 18' ' ' LYS . 1.3 mt -82.53 159.51 22.81 Favored 'General case' 0 C--O 1.231 0.1 0 C-N-CA 123.48 0.712 . . . . 0.0 109.539 170.445 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -122.6 88.95 49.79 Favored Pre-proline 0 C--N 1.328 -0.33 0 C-N-CA 125.665 1.586 . . . . 0.0 110.71 -173.475 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -62.09 126.3 18.39 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 123.777 2.985 . . . . 0.0 109.961 179.172 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -115.28 100.37 8.08 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 107.154 -1.425 . . . . 0.0 107.154 169.577 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 67.5 mtt-85 -52.64 -53.16 50.81 Favored 'General case' 0 N--CA 1.463 0.196 0 C-N-CA 124.584 1.154 . . . . 0.0 110.59 175.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.0 t -144.23 -177.75 5.62 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 122.313 1.054 . . . . 0.0 109.828 178.297 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -50.92 -39.1 53.78 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 126.571 1.948 . . . . 0.0 110.841 178.142 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -43.03 98.23 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.393 0.677 . . . . 0.0 111.222 178.185 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -68.2 -26.82 65.92 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 124.33 1.052 . . . . 0.0 110.773 -177.467 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.476 ' CZ3' HD23 ' A' ' 17' ' ' LEU . 60.8 t-105 -79.25 -41.18 28.79 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 123.663 0.785 . . . . 0.0 111.81 170.687 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -58.04 -45.66 86.63 Favored 'General case' 0 N--CA 1.462 0.132 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 178.167 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.466 0.344 0 C-N-CA 125.209 1.404 . . . . 0.0 112.363 173.371 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 49.0 mt . . . . . 0 CA--C 1.512 -0.491 0 N-CA-C 105.157 -2.164 . . . . 0.0 105.157 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -121.1 164.44 16.82 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 123.584 0.754 . . . . 0.0 109.81 -178.039 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.428 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 13.3 m-85 -60.34 138.64 57.93 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 176.668 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 84.2 9.12 82.67 Favored Glycine 0 CA--C 1.524 0.614 0 CA-C-O 119.106 -0.83 . . . . 0.0 113.496 174.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.404 ' HB3' HD11 ' A' ' 17' ' ' LEU . 2.2 m-20 -65.46 -25.88 67.7 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 119.41 1.605 . . . . 0.0 112.485 -171.637 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 19.9 ttmt 75.12 145.5 0.08 Allowed 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 129.523 3.129 . . . . 0.0 112.421 175.046 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 9.4 tp -135.57 157.86 45.82 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 107.521 -1.288 . . . . 0.0 107.521 171.005 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 24.2 t -134.45 141.89 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.74 0 C-N-CA 127.456 2.302 . . . . 0.0 106.27 167.565 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -104.11 176.65 5.08 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.897 1.279 . . . . 0.0 112.067 167.235 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -69.54 -5.41 24.08 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 -179.581 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 36.3 m120 -89.87 -1.27 57.95 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 119.412 1.005 . . . . 0.0 111.252 170.016 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 70.13 18.97 6.88 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 127.08 2.152 . . . . 0.0 110.959 -171.742 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 23.4 m170 -66.88 117.24 8.71 Favored 'General case' 0 C--N 1.34 0.164 0 O-C-N 120.801 -1.187 . . . . 0.0 108.891 169.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 72.6 m -83.11 156.32 23.35 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 118.997 0.817 . . . . 0.0 110.11 169.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -144.71 158.45 43.78 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 125.968 1.707 . . . . 0.0 109.313 177.816 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 24.4 t -115.86 162.73 13.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 C-N-CA 127.885 2.474 . . . . 0.0 106.907 169.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.52 HD12 ' O ' ' A' ' 66' ' ' HIS . 29.2 tp -111.82 133.45 54.02 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 166.328 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 62.1 mp0 -113.58 -172.8 2.14 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.742 2.017 . . . . 0.0 109.807 -171.02 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.428 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 2.5 mp0 -77.06 -18.31 58.15 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 120.734 -1.229 . . . . 0.0 113.3 178.777 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -75.25 -7.98 55.36 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 127.502 2.321 . . . . 0.0 113.444 -168.302 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 64.34 17.1 10.57 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 129.158 2.983 . . . . 0.0 114.376 -161.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.52 ' O ' HD12 ' A' ' 61' ' ' LEU . 1.1 p-80 -93.94 162.4 13.91 Favored 'General case' 0 C--N 1.34 0.195 0 C-N-CA 125.881 1.672 . . . . 0.0 114.336 164.746 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.415 ' NE1' HD13 ' A' ' 61' ' ' LEU . 62.0 m95 -106.58 106.41 16.92 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 106.644 -1.613 . . . . 0.0 106.644 164.143 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.406 ' CG ' ' HD2' ' A' ' 69' ' ' PRO . 0.1 OUTLIER -87.13 156.37 54.62 Favored Pre-proline 0 CA--C 1.545 0.773 0 C-N-CA 123.484 0.713 . . . . 0.0 109.104 175.083 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.406 ' HD2' ' CG ' ' A' ' 68' ' ' HIS . 66.9 Cg_endo -79.78 156.21 24.03 Favored 'Trans proline' 0 N--CA 1.455 -0.759 0 C-N-CA 122.303 2.002 . . . . 0.0 111.989 -172.151 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -132.25 31.91 4.04 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.056 1.342 . . . . 0.0 110.991 -177.519 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 71.72 165.42 0.13 Allowed Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 128.115 2.566 . . . . 0.0 111.802 179.219 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -71.43 -179.18 3.43 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 121.677 1.585 . . . . 0.0 109.927 169.226 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 12.8 tp -133.68 150.89 76.02 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-O 118.56 -0.733 . . . . 0.0 111.699 -174.569 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -61.97 159.47 33.81 Favored 'Trans proline' 0 CA--C 1.536 0.589 0 C-N-CA 122.178 1.919 . . . . 0.0 111.173 166.207 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -67.88 -38.06 14.17 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 122.329 2.019 . . . . 0.0 111.245 -178.04 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -72.86 -11.02 60.43 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 124.162 0.985 . . . . 0.0 110.569 175.74 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -68.78 -28.5 73.05 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-O 118.934 -0.926 . . . . 0.0 111.416 171.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 46.5 tp -62.88 -54.15 43.18 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 118.523 1.161 . . . . 0.0 108.728 170.473 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -50.24 -43.92 53.17 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.588 1.155 . . . . 0.0 111.661 177.36 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -60.78 -36.82 79.94 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 126.099 1.76 . . . . 0.0 112.724 177.846 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.423 HD13 ' HA ' ' A' ' 81' ' ' LEU . 1.2 mm? -72.22 -54.4 9.72 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 119.181 0.9 . . . . 0.0 109.84 172.81 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.406 ' HA ' ' CD1' ' A' ' 25' ' ' LEU . 4.4 mm -50.01 -37.82 13.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 126.372 1.869 . . . . 0.0 110.553 -177.709 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.01 -40.62 6.66 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 125.687 1.595 . . . . 0.0 112.661 176.3 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.417 ' HB1' ' HB3' ' A' ' 23' ' ' ASN . . . -60.34 -58.36 8.86 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 119.573 1.078 . . . . 0.0 111.581 178.88 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -58.82 -45.48 89.88 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 124.166 0.986 . . . . 0.0 109.383 -179.429 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 96.0 m -73.32 -17.18 61.33 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 120.641 -1.287 . . . . 0.0 112.774 -176.876 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -84.47 -20.62 31.42 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 119.396 0.998 . . . . 0.0 112.17 173.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.4 t -100.87 -17.35 16.89 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.37 0.532 . . . . 0.0 111.009 -178.496 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 52.2 mt -102.18 2.83 37.74 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.973 1.309 . . . . 0.0 111.166 165.709 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 66.59 15.4 64.0 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 125.187 1.375 . . . . 0.0 115.692 171.338 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 37.4 m-70 . . . . . 0 C--O 1.235 0.291 0 CA-C-N 119.5 1.65 . . . . 0.0 112.648 -174.14 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.226 -0.149 0 CA-C-O 121.007 0.432 . . . . 0.0 111.176 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 91.4 mt -155.08 121.87 5.42 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 126.259 1.824 . . . . 0.0 107.351 -155.555 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 32.1 t-80 -67.88 -37.1 81.36 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 117.889 0.313 . . . . 0.0 111.371 171.794 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 4.7 t -158.92 176.12 12.71 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.781 0.832 . . . . 0.0 111.477 -171.675 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 79.0 t -55.77 -36.9 44.85 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 C-N-CA 124.19 0.996 . . . . 0.0 108.988 167.392 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 26.0 tpp -60.01 -39.6 86.37 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.611 0.764 . . . . 0.0 112.311 178.237 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -61.28 -52.77 63.35 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 176.037 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.77 -41.7 70.82 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 125.005 1.322 . . . . 0.0 112.338 -171.458 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 22.4 mm -56.73 -46.89 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.266 0 CA-C-N 120.03 1.286 . . . . 0.0 111.127 -177.693 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -79.83 -36.89 36.18 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 118.164 0.438 . . . . 0.0 110.194 -178.27 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -59.77 -51.6 69.06 Favored 'General case' 0 C--N 1.337 0.056 0 C-N-CA 125.09 1.356 . . . . 0.0 110.978 -178.659 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 95.8 mt -68.06 -31.27 70.79 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 125.083 1.353 . . . . 0.0 110.902 -177.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -65.99 -40.15 90.93 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-O 118.894 -0.574 . . . . 0.0 110.8 175.693 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -75.07 0.68 15.25 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.583 1.153 . . . . 0.0 113.071 -179.533 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 45.4 mt . . . . . 0 N--CA 1.457 -0.109 0 CA-C-N 118.95 0.795 . . . . 0.0 110.488 166.766 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.7 p . . . . . 0 CA--C 1.537 0.479 0 N-CA-C 110.546 -0.168 . . . . 0.0 110.546 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -67.88 -55.0 0.29 Allowed 'Trans proline' 0 N--CA 1.459 -0.5 0 C-N-CA 122.467 2.111 . . . . 0.0 111.267 -169.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -135.75 144.29 48.23 Favored Pre-proline 0 C--O 1.238 0.482 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 176.83 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -77.4 -17.75 14.43 Favored 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 122.394 2.063 . . . . 0.0 111.965 -176.754 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -81.43 -26.43 35.36 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 117.636 -1.174 . . . . 0.0 111.964 173.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 tt -56.68 133.34 53.85 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.295 0.952 . . . . 0.0 109.823 -171.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 46.7 mm -112.71 116.37 52.4 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.123 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 -175.051 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 76.5 m95 -60.52 154.35 55.71 Favored Pre-proline 0 N--CA 1.45 -0.444 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.64 176.721 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -72.15 162.94 88.84 Favored 'Cis proline' 0 N--CA 1.458 -0.597 0 C-N-CA 124.853 -0.895 . . . . 0.0 112.684 -3.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -131.96 166.53 21.48 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 121.773 0.797 . . . . 0.0 110.966 179.237 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 38.6 mt -138.26 106.5 5.77 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 124.917 1.287 . . . . 0.0 108.813 -170.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.2 tp -84.67 148.79 26.23 Favored 'General case' 0 C--O 1.236 0.395 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 171.023 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -142.54 96.67 2.98 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 119.612 1.097 . . . . 0.0 108.592 167.135 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -55.15 151.57 9.14 Favored 'General case' 0 C--O 1.24 0.575 0 O-C-N 124.628 1.205 . . . . 0.0 112.425 -164.495 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -71.02 88.56 0.77 Allowed 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.512 0.672 . . . . 0.0 110.967 -177.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 137.15 -34.3 2.21 Favored Glycine 0 CA--C 1.524 0.633 0 C-N-CA 126.251 1.881 . . . . 0.0 110.618 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 85.3 m -76.86 177.07 7.96 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 122.89 1.329 . . . . 0.0 111.257 -178.536 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -128.82 -35.25 1.89 Allowed 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 126.712 2.005 . . . . 0.0 109.216 -175.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -59.69 131.71 51.76 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.231 1.412 . . . . 0.0 107.856 169.206 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.424 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -84.17 150.73 25.31 Favored 'General case' 0 CA--C 1.515 -0.393 0 C-N-CA 124.351 1.061 . . . . 0.0 108.678 164.232 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.424 HD22 ' HA ' ' A' ' 26' ' ' LEU . 0.2 OUTLIER -103.68 88.64 1.89 Allowed Pre-proline 0 C--N 1.327 -0.403 0 C-N-CA 128.294 2.637 . . . . 0.0 107.549 176.277 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -56.89 127.13 24.59 Favored 'Trans proline' 0 N--CA 1.45 -1.037 0 N-CA-C 108.988 -1.197 . . . . 0.0 108.988 169.602 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -118.22 103.54 9.94 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 106.089 -1.819 . . . . 0.0 106.089 166.456 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 67.8 mtt85 -56.74 -42.51 79.41 Favored 'General case' 0 CA--C 1.519 -0.213 0 O-C-N 122.279 -0.263 . . . . 0.0 110.562 174.774 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.429 HG23 ' H ' ' A' ' 32' ' ' ASP . 5.0 t -157.49 -177.47 6.62 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 118.344 0.52 . . . . 0.0 110.782 -177.834 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -51.95 -42.37 62.8 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 125.411 1.485 . . . . 0.0 110.695 174.256 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.429 ' H ' HG23 ' A' ' 30' ' ' THR . 22.0 t70 -54.44 -50.77 66.87 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-N 118.713 0.688 . . . . 0.0 110.639 175.627 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -57.2 -45.6 83.64 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.217 1.407 . . . . 0.0 110.368 178.018 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 39.6 t-105 -58.3 -40.93 83.31 Favored 'General case' 0 C--N 1.34 0.18 0 C-N-CA 123.8 0.84 . . . . 0.0 111.274 176.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -58.91 -45.25 90.76 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 178.472 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 8.4 mtt180 . . . . . 0 N--CA 1.456 -0.149 0 C-N-CA 124.056 0.943 . . . . 0.0 111.531 -168.978 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 72.3 mt . . . . . 0 N--CA 1.452 -0.338 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -158.91 131.14 6.7 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 104.652 -2.351 . . . . 0.0 104.652 -167.422 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.717 ' HA ' HD13 ' A' ' 61' ' ' LEU . 52.8 m-85 -60.07 144.08 50.46 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 -176.67 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.11 8.28 66.94 Favored Glycine 0 N--CA 1.443 -0.848 0 CA-C-O 118.292 -1.282 . . . . 0.0 114.812 -179.597 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.47 -9.76 14.31 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.542 1.937 . . . . 0.0 115.207 -174.029 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 15.8 ttmt 51.09 135.55 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.08 1 C-N-CA 132.025 4.13 . . . . 0.0 115.66 174.771 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 11.5 mt -129.38 157.57 41.58 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 121.088 -1.007 . . . . 0.0 109.568 174.523 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 37.4 t -135.26 141.35 42.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 127.476 2.31 . . . . 0.0 106.026 173.652 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -118.1 179.63 4.04 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.803 1.641 . . . . 0.0 111.781 172.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 98.5 p -61.12 -27.3 68.28 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.876 1.271 . . . . 0.0 113.653 -175.359 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -82.73 1.22 39.84 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 125.64 1.576 . . . . 0.0 110.745 178.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 61.3 23.73 13.92 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.542 1.537 . . . . 0.0 110.405 -170.142 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 27.8 m170 -61.08 124.04 19.39 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 120.699 1.59 . . . . 0.0 107.515 164.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.498 ' HB3' ' HB3' ' A' ' 70' ' ' ALA . 0.7 OUTLIER -88.5 145.85 25.51 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 107.138 -1.431 . . . . 0.0 107.138 166.785 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -135.99 155.69 49.87 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.192 0.997 . . . . 0.0 109.028 174.735 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 40.0 t -141.62 131.63 25.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 C-N-CA 128.046 2.538 . . . . 0.0 107.074 -177.693 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.717 HD13 ' HA ' ' A' ' 47' ' ' TYR . 0.2 OUTLIER -74.55 123.33 24.6 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 107.159 -1.422 . . . . 0.0 107.159 169.436 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -110.54 167.31 10.31 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.225 0.921 . . . . 0.0 109.438 173.559 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -59.54 -4.16 0.58 Allowed 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.848 1.259 . . . . 0.0 113.643 178.294 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -77.87 -2.73 38.11 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 120.606 -1.309 . . . . 0.0 111.755 167.525 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 70.68 -3.0 2.06 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 126.613 1.965 . . . . 0.0 112.286 -178.274 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -89.1 166.17 14.03 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 123.604 0.762 . . . . 0.0 110.737 175.508 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 68.5 m95 -107.35 97.41 7.17 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 125.616 1.567 . . . . 0.0 107.012 173.61 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 54.9 t-80 -79.81 145.09 61.28 Favored Pre-proline 0 CA--C 1.543 0.705 0 CA-C-O 118.122 -0.942 . . . . 0.0 110.222 -175.244 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -68.47 109.0 1.94 Allowed 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 124.166 3.244 . . . . 0.0 112.5 172.765 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.498 ' HB3' ' HB3' ' A' ' 58' ' ' CYS . . . -80.0 21.05 0.59 Allowed 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.287 1.435 . . . . 0.0 111.858 170.936 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 67.17 165.85 0.12 Allowed Pre-proline 0 C--O 1.237 0.434 0 C-N-CA 127.3 2.24 . . . . 0.0 111.817 -176.672 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -65.05 163.9 26.99 Favored 'Trans proline' 0 N--CA 1.447 -1.23 0 C-N-CA 120.81 1.007 . . . . 0.0 112.39 174.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 15.8 tp -118.95 146.75 40.95 Favored Pre-proline 0 CA--C 1.535 0.39 0 C-N-CA 126.279 1.832 . . . . 0.0 110.102 -173.737 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.49 164.35 31.23 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 122.278 1.985 . . . . 0.0 111.523 173.834 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -59.02 -33.54 98.77 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.843 2.362 . . . . 0.0 112.353 178.369 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -77.58 -24.71 49.7 Favored 'General case' 0 N--CA 1.454 -0.239 0 O-C-N 121.697 -0.627 . . . . 0.0 111.239 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -64.43 -29.13 74.25 Favored Glycine 0 CA--C 1.532 1.127 0 CA-C-N 118.4 0.545 . . . . 0.0 112.396 -174.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 37.5 tp -55.73 -53.0 61.98 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 124.871 1.268 . . . . 0.0 109.638 169.682 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -64.25 -25.78 68.21 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.255 0.622 . . . . 0.0 111.3 -173.51 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -72.26 -20.41 61.53 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.761 0.824 . . . . 0.0 112.521 177.186 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 67.1 mt -83.17 -50.22 8.67 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 118.924 0.784 . . . . 0.0 109.026 168.512 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.8 mm -50.87 -40.28 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 126.094 1.758 . . . . 0.0 111.655 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.82 -41.81 7.33 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 125.104 1.362 . . . . 0.0 110.751 176.728 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -73.78 -44.77 55.02 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -178.762 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.424 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 5.6 t60 -62.87 -45.06 94.32 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 119.682 1.128 . . . . 0.0 108.843 177.526 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 91.9 m -62.69 -41.05 98.92 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.484 177.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.69 -33.31 73.74 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -178.374 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 9.2 t -74.4 -38.89 62.98 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.971 0.805 . . . . 0.0 109.042 -177.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 78.4 mt -87.41 -52.11 5.55 Favored 'General case' 0 N--CA 1.462 0.166 0 O-C-N 121.659 -0.651 . . . . 0.0 109.772 -173.497 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 115.98 58.06 0.33 Allowed Glycine 0 CA--C 1.523 0.535 0 C-N-CA 125.971 1.748 . . . . 0.0 108.918 -179.314 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' HIS . . . . . 0.553 ' ND1' HD13 ' A' ' 112' ' ' LEU . 47.4 m170 . . . . . 0 C--O 1.236 0.372 0 C-N-CA 123.777 0.831 . . . . 0.0 110.895 -175.65 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.455 -0.207 0 CA-C-O 119.194 -0.432 . . . . 0.0 110.463 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.418 HD13 ' HB2' ' A' ' 105' ' ' ALA . 89.7 mt -154.3 163.38 40.23 Favored 'General case' 0 CA--C 1.514 -0.433 0 C-N-CA 127.119 2.168 . . . . 0.0 109.88 -170.427 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 16.0 t-160 -86.56 -37.39 18.2 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 123.692 0.797 . . . . 0.0 112.644 169.063 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 4.5 t -172.41 -178.92 2.11 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 118.582 0.628 . . . . 0.0 112.684 -165.629 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 45.2 t -68.05 -39.82 82.11 Favored 'Isoleucine or valine' 0 C--N 1.345 0.371 0 C-N-CA 124.048 0.939 . . . . 0.0 111.194 -179.066 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -59.89 -44.89 93.98 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 177.599 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.55 -49.71 67.09 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 127.388 2.275 . . . . 0.0 109.968 174.71 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.418 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -59.21 -56.29 24.0 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 124.924 1.29 . . . . 0.0 111.28 179.357 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 3.4 mm -60.17 -41.07 85.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -174.106 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -59.98 -50.05 75.27 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 124.032 0.933 . . . . 0.0 110.25 176.259 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.704 ' CE2' HD11 ' A' ' 112' ' ' LEU . 48.4 t80 -54.5 -67.46 0.26 Allowed 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 126.666 1.986 . . . . 0.0 110.022 178.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.54 ' HA ' HD12 ' A' ' 112' ' ' LEU . 6.9 mp -47.48 -49.95 24.44 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 125.266 1.426 . . . . 0.0 111.681 179.869 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 63.3 m-80 -79.44 -4.79 52.77 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -176.372 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -99.15 -25.59 14.48 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 119.559 1.072 . . . . 0.0 111.169 169.604 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.704 HD11 ' CE2' ' A' ' 108' ' ' PHE . 40.3 mt . . . . . 0 N--CA 1.45 -0.433 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 174.514 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 27.2 p . . . . . 0 C--O 1.238 0.457 0 N-CA-C 111.717 0.266 . . . . 0.0 111.717 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -74.53 95.66 0.95 Allowed 'Trans proline' 0 N--CA 1.45 -1.08 0 C-N-CA 123.244 2.63 . . . . 0.0 109.487 178.584 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 75.6 144.51 0.1 Allowed Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 128.294 2.638 . . . . 0.0 113.964 176.138 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -80.03 -20.56 8.69 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 122.877 2.385 . . . . 0.0 114.201 -178.051 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -78.12 -18.59 55.46 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 117.295 -1.336 . . . . 0.0 111.527 172.368 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 tt -60.89 127.0 29.44 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 121.276 1.853 . . . . 0.0 110.831 -174.675 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 44.6 mm -111.73 118.59 57.96 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.096 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 178.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 63.7 m95 -64.53 152.85 88.47 Favored Pre-proline 0 C--O 1.237 0.411 0 CA-C-O 118.53 -0.748 . . . . 0.0 110.5 173.355 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -70.17 160.2 89.66 Favored 'Cis proline' 0 N--CA 1.458 -0.593 0 C-N-CA 124.697 -0.96 . . . . 0.0 113.717 -1.323 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -119.6 168.36 11.1 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.972 0.909 . . . . 0.0 109.687 174.028 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 16.0 mt -140.25 91.25 2.43 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.885 2.074 . . . . 0.0 107.1 -179.263 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 26.8 tp -68.34 144.86 54.64 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 106.234 -1.765 . . . . 0.0 106.234 160.439 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -143.11 95.64 2.8 Favored 'General case' 0 CA--C 1.506 -0.743 0 N-CA-C 103.776 -2.675 . . . . 0.0 103.776 167.204 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -55.06 137.43 46.47 Favored 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 124.717 1.261 . . . . 0.0 109.861 -167.637 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.8 134.33 56.59 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-O 122.449 1.119 . . . . 0.0 109.051 175.684 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 97.73 -45.69 1.7 Allowed Glycine 0 CA--C 1.526 0.741 0 C-N-CA 126.251 1.881 . . . . 0.0 111.446 -172.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 66.3 m -68.44 165.59 18.57 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 118.216 1.008 . . . . 0.0 109.983 174.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.559 ' HB3' ' HB1' ' A' ' 84' ' ' ALA . 0.9 OUTLIER -116.48 -29.3 6.2 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.407 1.483 . . . . 0.0 108.267 173.931 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -64.98 144.98 56.93 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 127.426 2.29 . . . . 0.0 109.738 174.194 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.1 mt -99.98 161.43 13.61 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 125.885 1.674 . . . . 0.0 110.152 -176.289 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -115.05 85.96 13.0 Favored Pre-proline 0 C--O 1.236 0.345 0 C-N-CA 125.201 1.4 . . . . 0.0 108.622 164.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -65.88 135.22 40.33 Favored 'Trans proline' 0 N--CA 1.453 -0.905 0 C-N-CA 121.987 1.791 . . . . 0.0 108.502 168.706 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.5 mt -134.2 100.45 4.7 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 -177.121 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.6 mtt180 -58.92 -47.39 85.18 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.144 0.497 . . . . 0.0 111.175 -168.2 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 66.3 p -141.87 175.98 9.29 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -172.65 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -54.13 -36.48 63.32 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-O 119.132 -0.461 . . . . 0.0 110.446 166.647 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -67.38 -16.77 64.43 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -174.669 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -80.95 -43.93 18.99 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.345 1.058 . . . . 0.0 109.647 171.474 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 76.4 t-105 -64.89 -37.82 88.91 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.144 0.978 . . . . 0.0 111.877 176.868 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.9 mm100 -52.61 -48.47 66.31 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 124.666 1.187 . . . . 0.0 109.055 177.808 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 45.4 mtp85 . . . . . 0 N--CA 1.462 0.135 0 C-N-CA 124.839 1.256 . . . . 0.0 112.236 179.601 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 93.5 mt . . . . . 0 N--CA 1.447 -0.594 0 N-CA-C 105.63 -1.989 . . . . 0.0 105.63 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 26.3 pt20 -157.6 130.33 7.45 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 104.628 -2.36 . . . . 0.0 104.628 -173.318 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -56.87 132.53 52.79 Favored 'General case' 0 C--O 1.243 0.733 0 N-CA-C 105.554 -2.017 . . . . 0.0 105.554 175.354 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 100.76 -0.25 55.29 Favored Glycine 0 CA--C 1.534 1.264 0 CA-C-O 118.989 -0.895 . . . . 0.0 115.239 -176.598 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.58 -19.87 28.59 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 119.874 1.837 . . . . 0.0 115.282 -174.214 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt 62.13 136.37 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 129.786 3.234 . . . . 0.0 113.718 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 8.4 tp -126.76 153.0 46.13 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 174.487 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 27.5 t -132.67 128.83 57.99 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 N-CA-C 103.783 -2.673 . . . . 0.0 103.783 172.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -97.23 177.76 5.46 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 122.06 0.933 . . . . 0.0 110.748 168.112 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.1 t -60.65 -19.88 59.37 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.162 1.385 . . . . 0.0 112.763 -178.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -84.32 -14.08 50.66 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 120.535 1.516 . . . . 0.0 113.084 -176.013 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 67.85 41.65 2.1 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 118.853 0.751 . . . . 0.0 109.72 -158.522 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 31.6 m170 -91.78 127.64 37.32 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 154.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -90.07 159.44 16.82 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 173.04 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -144.48 161.02 40.11 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 123.43 0.692 . . . . 0.0 110.539 177.301 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 25.7 t -139.07 131.05 36.33 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 128.096 2.558 . . . . 0.0 106.881 177.099 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.07 130.67 38.69 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 105.936 -1.875 . . . . 0.0 105.936 171.878 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -123.27 166.83 14.6 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.194 1.397 . . . . 0.0 109.692 177.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -57.74 -27.91 63.42 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 119.861 -1.774 . . . . 0.0 114.86 -166.591 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -75.39 15.11 0.49 Allowed 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 128.803 2.841 . . . . 0.0 112.369 177.003 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 68.7 9.23 7.22 Favored 'General case' 0 C--N 1.355 0.825 0 C-N-CA 125.61 1.564 . . . . 0.0 113.231 167.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 2.5 p80 -101.31 159.48 15.23 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 122.386 1.089 . . . . 0.0 111.396 172.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 82.2 m95 -97.49 97.75 9.35 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 105.867 -1.901 . . . . 0.0 105.867 168.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 80.2 t60 -71.28 143.77 88.63 Favored Pre-proline 0 CA--C 1.538 0.511 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 175.452 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -68.38 105.83 1.31 Allowed 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.314 2.676 . . . . 0.0 108.97 173.472 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.67 43.74 0.69 Allowed 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 126.03 1.732 . . . . 0.0 110.892 -176.029 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.531 ' HB1' ' HD2' ' A' ' 72' ' ' PRO . . . 60.73 166.47 0.09 OUTLIER Pre-proline 0 CA--C 1.542 0.637 0 C-N-CA 125.666 1.586 . . . . 0.0 111.942 -167.755 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.531 ' HD2' ' HB1' ' A' ' 71' ' ' ALA . 57.6 Cg_endo -64.13 177.42 1.99 Allowed 'Trans proline' 0 N--CA 1.451 -1.002 0 C-N-CA 121.122 1.215 . . . . 0.0 111.977 168.852 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 6.0 tt -122.61 143.46 39.96 Favored Pre-proline 0 CA--C 1.534 0.347 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -79.73 165.27 22.59 Favored 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 122.085 1.857 . . . . 0.0 110.662 -175.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -65.17 -15.63 51.17 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 121.689 1.593 . . . . 0.0 113.248 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -89.32 -27.36 20.57 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.965 0.906 . . . . 0.0 112.925 172.094 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.54 -36.43 89.36 Favored Glycine 0 C--N 1.344 1.003 0 C-N-CA 124.738 1.161 . . . . 0.0 112.404 -166.399 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.0 tp -57.61 -48.24 79.96 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 125.687 1.595 . . . . 0.0 108.445 -178.232 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -62.29 -25.77 68.04 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 118.137 -0.935 . . . . 0.0 112.574 -173.383 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -72.61 -37.05 68.19 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.486 1.039 . . . . 0.0 111.551 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.4 mp -65.27 -49.98 67.51 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.837 0.855 . . . . 0.0 110.321 173.143 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 15.4 mm -52.19 -42.59 36.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 125.228 1.411 . . . . 0.0 109.178 174.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.4 ttt-85 -52.66 -18.04 1.6 Allowed 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 126.919 2.088 . . . . 0.0 114.61 175.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.559 ' HB1' ' HB3' ' A' ' 23' ' ' ASN . . . -90.1 -51.68 5.34 Favored 'General case' 0 CA--C 1.527 0.079 0 CA-C-N 120.235 1.379 . . . . 0.0 110.859 176.501 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -57.59 -48.15 80.19 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 121.958 0.885 . . . . 0.0 110.317 175.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 90.3 m -66.86 -36.66 82.82 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 121.52 -0.737 . . . . 0.0 110.877 -177.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.53 -46.72 84.7 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 118.521 0.601 . . . . 0.0 111.176 175.781 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.5 t -68.55 -31.44 70.66 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -172.801 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 91.0 mt -79.87 -57.44 3.65 Favored 'General case' 0 N--CA 1.463 0.185 0 O-C-N 121.06 -1.025 . . . . 0.0 110.619 176.443 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 127.25 39.66 0.37 Allowed Glycine 0 CA--C 1.533 1.18 0 C-N-CA 125.756 1.646 . . . . 0.0 112.853 -177.418 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 65.8 m-70 . . . . . 0 C--O 1.236 0.355 0 CA-C-N 119.21 1.505 . . . . 0.0 110.511 -177.185 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 . . . . . 0 N--CA 1.454 -0.238 0 CA-C-O 119.686 -0.197 . . . . 0.0 111.458 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 97.7 mt -135.42 116.9 14.76 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 125.231 1.412 . . . . 0.0 109.169 -156.498 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 10.6 t-80 -75.19 -26.31 58.91 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 172.769 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 79.1 p -159.21 172.98 17.07 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 119.481 1.037 . . . . 0.0 112.015 177.291 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 47.5 t -58.14 -43.46 85.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.261 166.366 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 1.2 ttm -55.85 -50.04 71.68 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 118.995 0.816 . . . . 0.0 110.355 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.41 -29.85 69.46 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 120.704 -0.398 . . . . 0.0 110.168 -178.31 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -69.27 -42.77 75.11 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 124.802 1.241 . . . . 0.0 112.823 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 32.7 mm -54.95 -39.86 51.0 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 172.598 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -69.34 -44.6 71.32 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 119.438 -0.315 . . . . 0.0 111.032 -178.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -57.71 -44.47 85.94 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.257 1.023 . . . . 0.0 111.001 176.858 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 12.4 mt -54.61 -35.97 63.97 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 124.929 1.292 . . . . 0.0 112.136 173.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -88.58 0.62 56.17 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.438 1.495 . . . . 0.0 112.516 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -112.92 3.52 16.34 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.872 1.669 . . . . 0.0 112.281 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 15.5 mt . . . . . 0 CA--C 1.527 0.07 0 C-N-CA 123.439 0.695 . . . . 0.0 109.809 167.074 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 19.5 p . . . . . 0 C--O 1.237 0.411 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -81.9 83.32 2.11 Favored 'Trans proline' 0 N--CA 1.444 -1.44 0 C-N-CA 121.723 1.616 . . . . 0.0 109.172 173.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 74.9 149.33 0.12 Allowed Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 127.706 2.402 . . . . 0.0 111.164 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -73.42 -34.0 6.34 Favored 'Trans proline' 0 CA--C 1.534 0.497 0 C-N-CA 122.007 1.804 . . . . 0.0 112.806 173.487 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -76.47 -11.89 59.95 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 118.807 0.73 . . . . 0.0 112.892 -171.329 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 tt -61.2 142.37 56.83 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.302 0.641 . . . . 0.0 110.066 167.349 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 34.1 mm -124.96 117.77 51.14 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 173.68 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 81.4 m95 -61.22 151.63 75.25 Favored Pre-proline 0 C--O 1.235 0.323 0 C-N-CA 122.771 0.429 . . . . 0.0 110.779 177.193 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -73.24 168.14 76.87 Favored 'Cis proline' 0 N--CA 1.457 -0.637 0 C-N-CA 125.122 -0.783 . . . . 0.0 114.027 -1.449 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -137.06 172.91 12.3 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.332 1.053 . . . . 0.0 110.685 177.491 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 17.2 mt -141.41 105.97 4.88 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 126.246 1.818 . . . . 0.0 108.681 -171.593 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 32.5 tp -87.92 150.35 23.53 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 125.262 1.425 . . . . 0.0 109.913 174.501 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -144.53 83.19 1.71 Allowed 'General case' 0 C--O 1.239 0.501 0 CA-C-N 120.176 1.353 . . . . 0.0 110.391 172.567 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -47.77 140.91 5.99 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 125.889 1.676 . . . . 0.0 113.296 -170.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -62.94 117.52 6.52 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.612 0.72 . . . . 0.0 110.642 -179.289 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 119.39 -62.21 0.47 Allowed Glycine 0 N--CA 1.451 -0.355 0 N-CA-C 108.575 -1.81 . . . . 0.0 108.575 -170.588 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -76.1 -179.75 5.16 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 123.434 1.588 . . . . 0.0 112.663 -166.763 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -124.78 -16.72 6.1 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 126.075 1.75 . . . . 0.0 109.319 176.417 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -77.47 109.98 11.86 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 -174.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.521 HD12 ' HB2' ' A' ' 85' ' ' HIS . 0.5 OUTLIER -65.65 148.3 51.98 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 119.604 -0.838 . . . . 0.0 108.947 172.419 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -104.34 87.68 1.78 Allowed Pre-proline 0 N--CA 1.447 -0.619 0 C-N-CA 126.314 1.846 . . . . 0.0 106.45 173.557 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -61.91 132.45 39.73 Favored 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 121.949 1.766 . . . . 0.0 108.526 170.434 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -118.61 103.28 9.56 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.923 1.289 . . . . 0.0 107.577 174.445 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 30.0 mtt180 -66.87 -38.99 87.37 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 119.415 1.007 . . . . 0.0 112.754 -169.366 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 15.5 p -152.55 166.81 30.87 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 126.367 1.867 . . . . 0.0 106.95 -170.67 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -47.75 -37.85 14.24 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.501 1.046 . . . . 0.0 112.636 175.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.02 -17.9 29.53 Favored 'General case' 0 C--O 1.231 0.095 0 C-N-CA 125.354 1.462 . . . . 0.0 114.275 -177.148 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -87.09 -47.28 9.04 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.479 1.912 . . . . 0.0 110.274 -175.195 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 53.4 t-105 -58.21 -34.69 70.67 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 120.659 -1.276 . . . . 0.0 110.267 176.318 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -51.21 -48.35 62.04 Favored 'General case' 0 C--N 1.341 0.234 0 C-N-CA 123.635 0.774 . . . . 0.0 110.105 173.876 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 5.2 mtt180 . . . . . 0 CA--C 1.517 -0.322 0 C-N-CA 125.711 1.604 . . . . 0.0 112.225 -169.377 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.521 ' N ' HE21 ' A' ' 46' ' ' GLN . 31.2 mt . . . . . 0 CA--C 1.523 -0.095 0 CA-C-O 121.235 0.54 . . . . 0.0 112.373 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.521 HE21 ' N ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -104.11 165.66 10.91 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.301 1.04 . . . . 0.0 111.06 -169.896 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 17.7 m-85 -73.08 79.29 1.23 Allowed 'General case' 0 C--O 1.234 0.264 0 C-N-CA 125.485 1.514 . . . . 0.0 109.711 177.196 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 150.84 -0.75 0.37 Allowed Glycine 0 N--CA 1.446 -0.696 0 CA-C-N 115.003 -0.999 . . . . 0.0 113.022 -167.148 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.04 -9.4 38.76 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 119.41 1.605 . . . . 0.0 114.621 -168.172 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt 44.23 126.44 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.785 1 C-N-CA 132.993 4.517 . . . . 0.0 114.837 179.756 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.0 tp -120.04 151.21 39.34 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 124.283 1.033 . . . . 0.0 108.252 170.324 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.41 HG11 HD13 ' A' ' 73' ' ' LEU . 33.8 t -134.8 146.27 31.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 105.535 -2.024 . . . . 0.0 105.535 161.496 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -120.95 -171.11 2.13 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 127.782 2.433 . . . . 0.0 110.701 178.477 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 88.8 p -63.93 -29.17 70.37 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -72.47 -14.72 61.74 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 124.121 0.968 . . . . 0.0 112.305 -178.379 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.63 ' CD1' HD22 ' A' ' 73' ' ' LEU . 48.3 m-85 51.15 57.33 6.75 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.196 0.999 . . . . 0.0 111.406 -177.58 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 11.0 m170 -120.75 13.02 11.49 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.377 1.071 . . . . 0.0 113.693 -171.392 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 57.0 m 43.05 124.99 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.541 1 C-N-CA 133.624 4.77 . . . . 0.0 113.573 176.871 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -126.54 141.88 51.72 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 121.362 -0.836 . . . . 0.0 109.171 178.264 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 30.5 t -130.9 146.13 34.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 C-N-CA 127.243 2.217 . . . . 0.0 105.698 169.489 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 21.4 tp -77.19 139.1 39.81 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 124.184 0.994 . . . . 0.0 108.607 177.104 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -108.0 167.2 10.16 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 125.789 1.636 . . . . 0.0 109.67 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -69.72 -9.85 56.02 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.82 0.848 . . . . 0.0 112.493 176.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.3 t0 -81.78 6.6 15.01 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.562 1.545 . . . . 0.0 111.087 166.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 53.01 8.25 0.09 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 128.053 2.541 . . . . 0.0 114.29 -169.625 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.2 p-80 -79.26 165.91 22.71 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 119.435 1.016 . . . . 0.0 109.405 169.638 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 75.6 m95 -102.45 122.31 44.07 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 106.838 -1.541 . . . . 0.0 106.838 170.001 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 63.0 t60 -98.99 143.68 26.82 Favored Pre-proline 0 CA--C 1.536 0.431 0 CA-C-O 118.379 -0.819 . . . . 0.0 109.186 -176.607 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -74.52 125.26 9.46 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 124.109 3.206 . . . . 0.0 110.754 173.557 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -116.72 39.33 3.21 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 125.021 1.328 . . . . 0.0 110.426 -168.077 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 67.61 164.35 0.13 Allowed Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 127.98 2.512 . . . . 0.0 111.949 -178.162 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -69.7 174.27 9.71 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.201 1.934 . . . . 0.0 114.26 -172.395 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.63 HD22 ' CD1' ' A' ' 56' ' ' PHE . 8.3 tt -128.75 143.64 49.32 Favored Pre-proline 0 CA--C 1.542 0.652 0 C-N-CA 126.663 1.985 . . . . 0.0 108.411 -175.614 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.463 ' O ' HD23 ' A' ' 73' ' ' LEU . 73.2 Cg_endo -85.6 165.45 10.57 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 123.14 2.56 . . . . 0.0 112.977 -178.137 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -60.15 -14.06 26.94 Favored 'Trans proline' 0 CA--C 1.531 0.361 0 C-N-CA 123.383 2.722 . . . . 0.0 114.77 177.776 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -101.31 -14.24 17.71 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.251 1.82 . . . . 0.0 112.493 177.13 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -75.22 -25.59 68.25 Favored Glycine 0 CA--C 1.53 1.003 0 O-C-N 121.133 -0.98 . . . . 0.0 112.916 -177.087 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 23.0 tp -50.75 -48.69 59.07 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 118.359 1.08 . . . . 0.0 109.333 166.539 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -68.31 -21.45 64.77 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.931 -168.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -69.31 -43.55 73.54 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 120.398 1.454 . . . . 0.0 111.565 172.062 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -60.34 -55.4 34.15 Favored 'General case' 0 CA--C 1.522 -0.098 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 175.779 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.8 mm -58.3 -33.28 47.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 123.609 0.763 . . . . 0.0 110.605 -176.048 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.9 -35.56 45.86 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 119.429 1.013 . . . . 0.0 112.219 175.668 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.26 -61.45 2.35 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 119.212 0.915 . . . . 0.0 109.365 176.173 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.521 ' HB2' HD12 ' A' ' 25' ' ' LEU . 12.8 t-80 -57.98 -36.56 72.78 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.876 0.871 . . . . 0.0 112.194 -175.916 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 96.7 m -70.39 -54.37 12.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 118.358 -0.83 . . . . 0.0 110.973 175.274 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.14 -24.99 65.06 Favored 'General case' 0 C--O 1.23 0.074 0 CA-C-N 118.862 0.755 . . . . 0.0 112.03 -171.332 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.4 t -76.85 -15.37 59.73 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 118.653 -0.689 . . . . 0.0 110.755 178.304 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 83.6 mt -114.77 -58.28 2.16 Favored 'General case' 0 C--N 1.343 0.324 0 CA-C-N 119.636 1.107 . . . . 0.0 110.6 -174.575 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 149.36 5.55 0.22 Allowed Glycine 0 CA--C 1.528 0.901 0 CA-C-O 118.93 -0.928 . . . . 0.0 113.9 -173.157 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' HIS . . . . . 0.651 ' CD2' HD13 ' A' ' 112' ' ' LEU . 5.2 m-70 . . . . . 0 C--O 1.238 0.453 0 CA-C-N 119.511 1.656 . . . . 0.0 110.74 -161.558 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 1.2 m80 . . . . . 0 CA--C 1.532 0.256 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.456 HD13 ' HB2' ' A' ' 105' ' ' ALA . 81.6 mt -147.19 133.67 19.74 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 125.829 1.652 . . . . 0.0 108.102 -173.58 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 47.1 t-80 -67.6 -42.9 81.72 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 124.294 0.996 . . . . 0.0 111.807 179.037 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -170.2 -179.2 3.03 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.243 1.417 . . . . 0.0 109.157 -173.387 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 16.0 t -59.26 -40.62 81.71 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 C-N-CA 123.824 0.85 . . . . 0.0 110.818 -175.28 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -54.15 -45.67 72.08 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.875 0.87 . . . . 0.0 109.829 178.401 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -63.12 -41.53 99.36 Favored 'General case' 0 C--N 1.333 -0.115 0 C-N-CA 124.746 1.218 . . . . 0.0 110.564 -178.288 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.456 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -60.56 -50.17 74.63 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 124.224 1.01 . . . . 0.0 111.135 178.392 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 14.0 mm -66.31 -37.09 78.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -174.147 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -61.91 -47.97 82.54 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 118.763 0.711 . . . . 0.0 110.168 174.807 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -52.83 -63.7 1.06 Allowed 'General case' 0 C--N 1.342 0.257 0 C-N-CA 125.323 1.449 . . . . 0.0 111.59 179.244 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.411 ' HG ' ' CE1' ' A' ' 85' ' ' HIS . 8.7 mp -51.43 -47.0 63.15 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.702 1.201 . . . . 0.0 110.993 -179.617 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -73.28 -18.36 61.22 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 121.663 -0.648 . . . . 0.0 112.377 -178.565 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -85.48 -22.85 28.05 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.357 1.063 . . . . 0.0 111.418 176.127 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.651 HD13 ' CD2' ' A' ' 91' ' ' HIS . 22.5 mt . . . . . 0 N--CA 1.453 -0.318 0 C-N-CA 124.133 0.973 . . . . 0.0 109.065 172.591 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 10.3 p . . . . . 0 CA--C 1.54 0.588 0 CA-C-O 119.227 -0.416 . . . . 0.0 110.771 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -79.31 90.2 1.29 Allowed 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 123.865 3.043 . . . . 0.0 110.258 -178.584 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 74.54 144.72 0.11 Allowed Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 127.898 2.479 . . . . 0.0 111.194 -175.218 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -77.94 -20.41 11.69 Favored 'Trans proline' 0 CA--C 1.535 0.534 0 C-N-CA 122.349 2.032 . . . . 0.0 113.507 -178.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -90.22 -15.89 30.51 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.256 0.622 . . . . 0.0 112.634 -175.088 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.8 tt -62.74 142.49 58.12 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 118.936 0.789 . . . . 0.0 109.806 170.858 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 18.2 mm -126.95 136.47 60.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 C-N-CA 124.194 0.998 . . . . 0.0 108.607 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 75.1 m95 -77.94 156.86 79.56 Favored Pre-proline 0 CA--C 1.543 0.693 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 -178.364 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -67.34 163.33 74.14 Favored 'Cis proline' 0 N--CA 1.458 -0.568 0 C-N-CA 124.633 -0.986 . . . . 0.0 113.355 -9.817 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -131.79 171.22 13.79 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.218 1.807 . . . . 0.0 110.016 176.171 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.7 mt -141.52 107.13 5.07 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 125.611 1.564 . . . . 0.0 107.63 -174.256 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.1 tp -84.14 151.27 24.99 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 169.306 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.453 ' HE3' ' O ' ' A' ' 22' ' ' CYS . 0.1 OUTLIER -142.58 91.5 2.32 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 171.894 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -48.31 136.0 12.92 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 124.522 1.139 . . . . 0.0 110.939 -168.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -66.28 91.5 0.17 Allowed 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 122.122 0.963 . . . . 0.0 111.808 -172.172 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 137.73 -40.43 1.49 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 124.942 1.258 . . . . 0.0 110.308 -178.56 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.453 ' O ' ' HE3' ' A' ' 18' ' ' LYS . 62.7 m -65.71 173.16 2.97 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 121.544 0.687 . . . . 0.0 110.281 177.876 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -122.04 -32.36 3.72 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 176.504 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -60.76 137.89 58.16 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 124.682 1.193 . . . . 0.0 108.417 170.582 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.4 mt -87.46 154.07 20.93 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 124.427 1.091 . . . . 0.0 108.987 168.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -111.91 86.72 7.71 Favored Pre-proline 0 CA--C 1.542 0.64 0 N-CA-C 105.847 -1.908 . . . . 0.0 105.847 175.703 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -60.56 140.74 92.81 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 123.936 3.091 . . . . 0.0 109.412 174.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.5 mt -132.89 96.69 3.84 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 106.654 -1.61 . . . . 0.0 106.654 -178.066 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.8 mtt-85 -53.7 -45.6 70.45 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 124.27 1.028 . . . . 0.0 110.882 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.4 t -157.19 178.14 10.68 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 -172.476 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -56.84 -34.65 67.97 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 123.716 0.807 . . . . 0.0 111.696 171.178 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -63.07 -17.74 62.61 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.539 1.063 . . . . 0.0 111.601 177.363 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -81.55 -44.71 16.93 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.689 1.596 . . . . 0.0 109.03 175.453 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 57.6 t-105 -57.72 -33.01 67.97 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.051 1.741 . . . . 0.0 112.481 174.532 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 -65.03 -50.25 66.96 Favored 'General case' 0 C--O 1.232 0.155 0 O-C-N 120.436 -1.415 . . . . 0.0 110.769 172.109 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 50.6 mtp85 . . . . . 0 C--O 1.227 -0.119 0 CA-C-O 117.207 -1.378 . . . . 0.0 112.091 -175.802 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 81.1 mt . . . . . 0 C--O 1.235 0.323 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -136.95 157.58 46.42 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 124.621 1.168 . . . . 0.0 109.545 -173.191 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -65.2 121.33 14.52 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 107.513 -1.291 . . . . 0.0 107.513 179.481 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 97.1 10.77 54.37 Favored Glycine 0 CA--C 1.535 1.299 0 CA-C-O 117.482 -1.732 . . . . 0.0 114.404 -177.71 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.3 -13.67 41.25 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-N 120.441 2.121 . . . . 0.0 115.466 178.52 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt 47.73 144.46 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.531 1 C-N-CA 134.815 5.246 . . . . 0.0 114.632 -176.721 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 14.8 mt -126.58 156.21 41.23 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 166.271 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 17.3 t -130.57 141.8 45.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 N-CA-C 104.552 -2.388 . . . . 0.0 104.552 163.422 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -98.66 179.78 4.56 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.276 1.03 . . . . 0.0 110.539 173.129 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.6 m -61.98 -3.09 1.07 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 115.881 1.808 . . . . 0.0 115.881 174.573 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 -120.79 16.2 11.84 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 127.04 2.136 . . . . 0.0 110.368 -176.076 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 65.33 13.94 9.11 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.819 2.048 . . . . 0.0 112.874 175.62 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 31.1 m170 -69.04 110.0 4.27 Favored 'General case' 0 C--N 1.329 -0.285 0 O-C-N 120.191 -1.568 . . . . 0.0 109.121 174.813 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -71.22 143.74 50.34 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 119.501 1.046 . . . . 0.0 108.76 167.524 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -135.65 159.49 41.47 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 125.397 1.479 . . . . 0.0 109.602 -179.326 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 30.3 t -141.64 141.33 30.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 C-N-CA 128.158 2.583 . . . . 0.0 105.961 -174.007 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 22.8 tp -94.42 132.73 38.76 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 128.299 2.64 . . . . 0.0 105.657 174.046 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 73.3 mt-10 -128.99 174.72 9.28 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.291 1.036 . . . . 0.0 112.11 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -68.38 -18.5 64.48 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 125.622 1.569 . . . . 0.0 114.516 -166.471 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -77.0 12.34 1.43 Allowed 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.067 1.347 . . . . 0.0 111.256 174.806 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 45.91 48.48 12.16 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 126.241 1.816 . . . . 0.0 109.693 -170.646 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -120.44 161.51 21.11 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.544 0.687 . . . . 0.0 110.876 162.426 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 81.6 m95 -94.75 154.56 17.23 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 106.043 -1.836 . . . . 0.0 106.043 158.251 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -142.46 161.34 50.45 Favored Pre-proline 0 CA--C 1.54 0.569 0 C-N-CA 123.935 0.894 . . . . 0.0 111.079 -176.02 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.04 134.42 27.35 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 124.313 3.342 . . . . 0.0 111.153 172.782 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -129.01 21.11 5.83 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.234 1.414 . . . . 0.0 112.833 -176.524 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 75.59 154.5 0.15 Allowed Pre-proline 0 CA--C 1.539 0.551 0 C-N-CA 131.479 3.912 . . . . 0.0 113.496 -177.22 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -72.0 163.58 38.34 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 121.756 1.638 . . . . 0.0 113.419 -176.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.4 tt -102.37 143.58 26.9 Favored Pre-proline 0 CA--C 1.545 0.762 0 C-N-CA 126.263 1.825 . . . . 0.0 109.273 -173.507 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -83.01 166.82 14.54 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 123.954 3.103 . . . . 0.0 111.706 -176.04 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -64.14 -21.27 67.84 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 121.626 1.551 . . . . 0.0 112.96 -175.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -90.34 -20.45 22.85 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.652 1.581 . . . . 0.0 112.928 175.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.02 -32.55 84.53 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-N 119.518 1.054 . . . . 0.0 111.104 -175.645 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 32.5 tp -59.67 -51.23 70.67 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.065 0.946 . . . . 0.0 108.511 178.62 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -61.28 -25.05 66.84 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.274 1.829 . . . . 0.0 111.061 178.871 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -76.43 -47.5 22.87 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.524 1.056 . . . . 0.0 111.029 176.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.42 HD13 ' HA ' ' A' ' 81' ' ' LEU . 1.4 mm? -61.2 -50.35 73.47 Favored 'General case' 0 CA--C 1.521 -0.16 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 177.24 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.7 mm -53.73 -42.24 50.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 C-N-CA 124.022 0.929 . . . . 0.0 109.672 -179.015 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.9 ttt85 -51.38 -38.57 54.01 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 120.017 1.28 . . . . 0.0 113.614 177.379 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.15 -49.64 75.06 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 119.774 1.17 . . . . 0.0 109.987 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 24.0 t60 -60.69 -46.0 92.05 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.863 0.865 . . . . 0.0 109.716 176.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 73.2 m -65.04 -34.47 78.51 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 118.297 -0.859 . . . . 0.0 111.886 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -71.45 -40.82 70.11 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 119.019 0.827 . . . . 0.0 111.122 -177.566 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 8.6 t -71.42 -35.04 70.82 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 118.989 -0.529 . . . . 0.0 110.187 -175.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 64.3 mt -78.42 -47.13 18.2 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 175.582 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 99.04 53.33 1.18 Allowed Glycine 0 CA--C 1.527 0.838 0 C-N-CA 127.247 2.356 . . . . 0.0 110.625 -178.43 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 35.3 m-70 . . . . . 0 CA--C 1.536 0.428 0 C-N-CA 126.118 1.767 . . . . 0.0 111.688 -177.913 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 8.5 m80 . . . . . 0 C--O 1.232 0.16 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.522 HD13 ' HB2' ' A' ' 105' ' ' ALA . 94.1 mt -145.5 154.41 42.18 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 126.205 1.802 . . . . 0.0 108.503 -165.05 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -96.41 -28.78 14.29 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.127 -0.488 . . . . 0.0 112.271 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.6 t -171.63 179.85 2.72 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.432 1.493 . . . . 0.0 108.508 -177.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 60.6 t -65.21 -37.09 79.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 O-C-N 121.325 -0.859 . . . . 0.0 110.989 -177.445 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 3.7 tpt -59.05 -38.56 79.65 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 121.916 -0.49 . . . . 0.0 109.919 177.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -63.73 -44.31 93.94 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 124.27 1.028 . . . . 0.0 109.166 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.522 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -55.67 -52.0 65.32 Favored 'General case' 0 C--N 1.34 0.195 0 C-N-CA 125.599 1.56 . . . . 0.0 112.404 -178.221 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 30.0 mm -61.98 -44.08 98.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 -175.491 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.68 -40.78 92.71 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.151 0.58 . . . . 0.0 110.418 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -55.28 -55.17 34.5 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 124.318 1.047 . . . . 0.0 109.686 176.02 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 6.8 mt -61.64 -45.57 93.48 Favored 'General case' 0 CA--C 1.517 -0.315 0 O-C-N 124.182 0.926 . . . . 0.0 110.679 -176.606 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 -59.35 -43.41 92.81 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 118.988 -0.53 . . . . 0.0 110.065 179.378 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.8 -12.76 61.86 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 -177.388 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 57.2 mt . . . . . 0 N--CA 1.465 0.3 0 CA-C-N 120.155 1.343 . . . . 0.0 109.162 177.254 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.236 0.381 0 CA-C-O 118.625 -0.703 . . . . 0.0 110.816 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -68.4 -54.66 0.28 Allowed 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.598 2.199 . . . . 0.0 111.931 176.775 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 20.3 t-80 -161.94 144.21 8.71 Favored Pre-proline 0 CA--C 1.536 0.427 0 CA-C-N 119.853 1.206 . . . . 0.0 108.661 174.515 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -73.64 -1.73 11.16 Favored 'Trans proline' 0 CA--C 1.536 0.609 0 C-N-CA 122.93 2.42 . . . . 0.0 114.216 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -113.11 -3.93 13.89 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.743 1.217 . . . . 0.0 112.23 177.917 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.7 tt -66.77 117.02 8.31 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 163.339 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 29.4 mm -100.05 103.9 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 177.492 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 71.9 m95 -53.47 150.51 12.28 Favored Pre-proline 0 CA--C 1.533 0.292 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.761 176.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -68.88 167.91 66.2 Favored 'Cis proline' 0 N--CA 1.456 -0.696 0 N-CA-C 114.878 1.069 . . . . 0.0 114.878 -0.601 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -139.23 167.78 21.3 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 124.831 1.252 . . . . 0.0 110.741 -179.483 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.5 mt -140.53 114.32 8.9 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 125.734 1.613 . . . . 0.0 108.488 -172.239 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.481 HD11 ' HB3' ' A' ' 49' ' ' ASP . 18.7 tp -95.7 143.77 26.67 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.602 1.561 . . . . 0.0 109.015 178.606 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -146.21 98.05 3.03 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 119.616 1.098 . . . . 0.0 110.769 175.485 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -58.87 160.31 5.99 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-O 122.687 1.232 . . . . 0.0 112.658 -173.457 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -76.12 99.87 4.8 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 122.63 1.205 . . . . 0.0 111.981 174.777 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 126.89 -39.43 1.97 Allowed Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 126.229 1.871 . . . . 0.0 108.506 169.326 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 41.6 m -65.67 165.07 13.18 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 124.568 1.147 . . . . 0.0 109.647 174.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 -122.16 -28.16 4.42 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 124.914 1.286 . . . . 0.0 109.539 -178.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -60.82 115.11 3.43 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 127.825 2.45 . . . . 0.0 109.177 -178.048 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -72.4 147.61 46.04 Favored 'General case' 0 N--CA 1.463 0.197 0 O-C-N 121.103 -0.998 . . . . 0.0 109.496 172.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.06 87.61 9.08 Favored Pre-proline 0 CA--C 1.535 0.369 0 C-N-CA 125.48 1.512 . . . . 0.0 108.945 176.084 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -63.48 127.54 20.15 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 122.641 2.227 . . . . 0.0 110.73 172.448 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -114.72 107.75 15.87 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 125.996 1.718 . . . . 0.0 107.604 169.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.7 mtt-85 -61.85 -45.79 92.29 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.045 0.384 . . . . 0.0 111.186 -178.248 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 13.3 t -146.85 -176.1 5.07 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 121.918 0.866 . . . . 0.0 110.54 174.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -54.44 -38.35 66.21 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 124.789 1.236 . . . . 0.0 110.085 -179.557 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.73 -19.85 63.54 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 121.423 0.63 . . . . 0.0 111.498 -177.373 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -78.47 -35.12 47.05 Favored 'General case' 0 CA--C 1.521 -0.164 0 O-C-N 120.151 -1.593 . . . . 0.0 109.923 175.646 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 49.9 t-105 -64.03 -34.93 79.12 Favored 'General case' 0 C--O 1.234 0.266 0 O-C-N 121.455 -0.778 . . . . 0.0 110.615 170.564 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -57.5 -57.15 13.96 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-O 118.834 -0.603 . . . . 0.0 109.771 168.516 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.552 1.025 0 C-N-CA 117.543 -1.663 . . . . 0.0 109.632 -168.499 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 57.9 mt . . . . . 0 N--CA 1.454 -0.243 0 N-CA-C 107.646 -1.242 . . . . 0.0 107.646 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -129.7 147.21 51.46 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.656 1.582 . . . . 0.0 107.943 -177.431 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.591 ' HA ' HD13 ' A' ' 61' ' ' LEU . 40.3 m-85 -67.16 91.32 0.22 Allowed 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 124.858 1.263 . . . . 0.0 110.629 -167.435 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 140.48 15.93 0.48 Allowed Glycine 0 CA--C 1.528 0.889 0 C-N-CA 124.203 0.906 . . . . 0.0 113.336 -179.187 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.481 ' HB3' HD11 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -56.13 -9.97 0.74 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 127.768 2.427 . . . . 0.0 115.321 171.779 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.2 ttmt 44.42 115.69 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 130.808 3.643 . . . . 0.0 113.737 175.536 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 16.1 mt -104.42 155.19 19.0 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 167.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 23.7 t -136.81 142.94 36.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 N-CA-C 105.952 -1.87 . . . . 0.0 105.952 160.437 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.68 -170.56 1.78 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.829 1.652 . . . . 0.0 111.018 179.126 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.6 m -72.55 -15.69 61.76 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 176.499 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 -80.14 -3.95 50.93 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.829 1.251 . . . . 0.0 112.469 168.337 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 63.88 19.49 11.76 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.521 1.128 . . . . 0.0 109.88 -170.009 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 66.6 m170 -67.06 107.44 2.28 Favored 'General case' 0 CA--C 1.518 -0.266 0 O-C-N 120.215 -1.553 . . . . 0.0 106.918 170.589 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -74.04 153.86 39.49 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 121.952 0.882 . . . . 0.0 109.577 168.552 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -135.4 167.95 20.11 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 125.784 1.633 . . . . 0.0 108.511 -178.531 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 53.4 t -145.21 142.01 22.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 104.772 -2.307 . . . . 0.0 104.772 172.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.591 HD13 ' HA ' ' A' ' 47' ' ' TYR . 0.1 OUTLIER -81.6 124.53 29.62 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 106.379 -1.712 . . . . 0.0 106.379 170.461 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -109.21 161.25 15.41 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 118.516 0.598 . . . . 0.0 109.533 -178.496 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -55.84 -14.84 2.63 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -175.528 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.93 -11.04 57.98 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.937 1.295 . . . . 0.0 112.78 170.613 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 74.45 8.16 4.49 Favored 'General case' 0 C--N 1.351 0.643 0 C-N-CA 126.236 1.815 . . . . 0.0 111.193 -165.33 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -94.26 164.35 13.07 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 118.783 0.72 . . . . 0.0 111.403 177.081 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -107.96 107.28 17.91 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 107.645 -1.242 . . . . 0.0 107.645 173.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 -79.98 143.58 57.72 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -71.78 105.27 1.76 Allowed 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 124.606 3.537 . . . . 0.0 109.815 170.329 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.92 28.69 0.09 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.061 1.344 . . . . 0.0 111.559 170.026 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.494 ' HB1' ' HD2' ' A' ' 72' ' ' PRO . . . 67.8 166.71 0.12 Allowed Pre-proline 0 CA--C 1.539 0.53 0 C-N-CA 125.79 1.636 . . . . 0.0 111.602 -178.466 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.494 ' HD2' ' HB1' ' A' ' 71' ' ' ALA . 72.0 Cg_endo -64.36 162.88 28.62 Favored 'Trans proline' 0 N--CA 1.45 -1.052 0 C-N-CA 120.47 0.78 . . . . 0.0 110.925 168.609 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 20.7 tp -122.67 144.63 43.01 Favored Pre-proline 0 N--CA 1.448 -0.575 0 C-N-CA 126.717 2.007 . . . . 0.0 106.262 -178.825 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -62.24 160.68 29.8 Favored 'Trans proline' 0 N--CA 1.453 -0.91 0 C-N-CA 121.608 1.538 . . . . 0.0 110.445 174.191 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -59.97 -25.12 78.72 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 122.28 1.987 . . . . 0.0 112.487 179.168 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -89.2 -20.04 24.68 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 126.549 1.94 . . . . 0.0 109.764 -174.879 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.06 -23.17 78.37 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 123.814 0.721 . . . . 0.0 112.432 176.588 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 27.9 tp -55.66 -46.99 77.42 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.311 1.044 . . . . 0.0 109.847 169.243 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -58.45 -26.17 63.03 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.452 1.501 . . . . 0.0 111.379 -175.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -74.79 -24.35 58.64 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.18 1.392 . . . . 0.0 113.158 177.436 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 93.7 mt -84.94 -53.56 5.23 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 175.71 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.7 mm -56.74 -28.06 27.11 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 125.395 1.478 . . . . 0.0 110.258 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -44.14 -46.45 8.75 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 125.581 1.552 . . . . 0.0 111.172 174.418 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.73 -48.77 77.77 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 123.525 0.73 . . . . 0.0 111.718 -176.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.441 ' NE2' HD12 ' A' ' 112' ' ' LEU . 13.0 t60 -59.32 -46.62 88.11 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.368 0.667 . . . . 0.0 109.716 177.694 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 78.2 m -68.92 -31.99 71.28 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 120.896 -1.127 . . . . 0.0 111.129 -178.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -80.63 -12.51 59.49 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 125.111 1.365 . . . . 0.0 113.557 -179.67 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.0 t -95.57 -4.41 44.7 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.107 0.867 . . . . 0.0 110.981 170.672 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 88.9 mt -122.72 -46.84 2.1 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 119.89 1.223 . . . . 0.0 111.66 -174.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 119.95 57.59 0.25 Allowed Glycine 0 CA--C 1.528 0.891 0 C-N-CA 125.239 1.399 . . . . 0.0 112.529 178.125 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.47 0.556 0 CA-C-N 118.975 1.388 . . . . 0.0 112.674 -179.183 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 17.2 t-160 . . . . . 0 CA--C 1.519 -0.245 0 CA-C-O 119.244 -0.408 . . . . 0.0 111.86 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.614 HD13 ' HB2' ' A' ' 105' ' ' ALA . 84.2 mt -138.85 146.76 41.6 Favored 'General case' 0 CA--C 1.514 -0.43 0 C-N-CA 124.647 1.179 . . . . 0.0 107.907 169.306 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 -79.45 -36.31 39.06 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 124.557 1.143 . . . . 0.0 112.539 -179.671 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 24.2 p -170.64 174.0 5.19 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 126.18 1.792 . . . . 0.0 108.625 -177.649 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 68.7 t -62.62 -45.74 98.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-O 118.714 -0.66 . . . . 0.0 109.929 177.067 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 46.8 tpp -62.77 -46.05 89.82 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.843 1.201 . . . . 0.0 110.155 -177.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.29 -35.44 69.8 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 178.459 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.614 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -62.42 -41.77 98.94 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 123.652 0.781 . . . . 0.0 112.492 174.332 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 29.1 mm -56.02 -49.99 72.33 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-N 119.364 0.984 . . . . 0.0 108.889 -177.573 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.67 -40.73 63.47 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.123 -176.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.445 ' CE2' HD11 ' A' ' 112' ' ' LEU . 90.4 t80 -50.29 -59.16 4.24 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.535 0.734 . . . . 0.0 111.454 173.736 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 74.4 mt -58.29 -35.57 72.0 Favored 'General case' 0 CA--C 1.522 -0.125 0 C-N-CA 125.289 1.436 . . . . 0.0 112.159 -174.487 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -69.16 -46.12 68.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 119.227 -0.416 . . . . 0.0 110.355 174.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -69.61 -11.65 61.01 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.132 0.973 . . . . 0.0 112.829 -178.132 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.445 HD11 ' CE2' ' A' ' 108' ' ' PHE . 19.8 mt . . . . . 0 N--CA 1.454 -0.263 0 CA-C-N 119.279 0.945 . . . . 0.0 110.687 169.849 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 14.2 p . . . . . 0 C--O 1.239 0.519 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -97.47 84.06 0.07 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.173 0 C-N-CA 122.61 2.207 . . . . 0.0 110.588 -177.322 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 75.4 143.66 0.1 OUTLIER Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 128.91 2.884 . . . . 0.0 110.455 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -84.11 -15.89 6.47 Favored 'Trans proline' 0 CA--C 1.535 0.548 0 C-N-CA 122.921 2.414 . . . . 0.0 112.21 175.476 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.9 -13.52 59.98 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.736 0.814 . . . . 0.0 110.559 175.74 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 tt -68.43 130.97 44.46 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-N 118.385 0.539 . . . . 0.0 110.542 169.448 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 8.0 mm -119.08 102.55 13.16 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 126.602 1.961 . . . . 0.0 108.258 -179.199 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 84.5 m95 -58.84 148.83 67.42 Favored Pre-proline 0 CA--C 1.54 0.566 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 -175.327 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.99 172.45 56.93 Favored 'Cis proline' 0 N--CA 1.455 -0.776 0 N-CA-C 114.271 0.835 . . . . 0.0 114.271 5.348 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.449 ' HB1' HD22 ' A' ' 51' ' ' LEU . . . -144.17 166.11 25.96 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.306 172.925 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.9 mt -132.91 105.97 7.42 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 125.29 1.436 . . . . 0.0 107.333 -178.875 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 29.9 tp -66.9 142.03 57.44 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 171.321 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.14 94.53 2.54 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 107.47 -1.307 . . . . 0.0 107.47 165.365 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -59.32 155.9 13.7 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 126.013 1.725 . . . . 0.0 110.145 -173.215 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -63.79 116.47 5.78 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 127.453 2.301 . . . . 0.0 109.726 -173.228 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 79.9 -11.22 35.79 Favored Glycine 0 CA--C 1.528 0.898 0 CA-C-O 118.523 -1.154 . . . . 0.0 113.516 178.516 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 50.7 m -72.05 178.14 3.96 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.644 1.722 . . . . 0.0 109.688 167.419 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -142.47 -22.13 0.67 Allowed 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 125.166 1.386 . . . . 0.0 111.704 -178.89 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.49 148.14 49.92 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 166.849 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -104.96 150.09 25.2 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 170.831 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.448 HD22 ' HA ' ' A' ' 26' ' ' LEU . 0.2 OUTLIER -106.75 88.54 3.58 Favored Pre-proline 0 C--O 1.234 0.254 0 C-N-CA 126.923 2.089 . . . . 0.0 110.883 175.372 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -56.82 131.32 44.85 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.579 2.186 . . . . 0.0 110.337 177.716 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -123.55 97.63 5.47 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 125.91 1.684 . . . . 0.0 107.477 172.09 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.5 mtt85 -56.18 -45.54 79.71 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 118.584 0.629 . . . . 0.0 110.939 177.298 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 12.3 t -148.82 -175.6 5.01 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 121.737 0.779 . . . . 0.0 110.054 173.164 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -54.12 -34.58 60.66 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.176 1.39 . . . . 0.0 111.61 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -61.22 -41.23 96.48 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.216 0.532 . . . . 0.0 109.878 178.281 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.422 ' HA ' ' HD2' ' A' ' 36' ' ' ARG . 16.9 m-20 -70.49 -27.87 64.54 Favored 'General case' 0 C--O 1.232 0.141 0 C-N-CA 125.471 1.508 . . . . 0.0 110.639 -177.946 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 42.5 t-105 -68.08 -50.97 51.67 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.989 0.916 . . . . 0.0 110.242 166.566 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -58.76 -38.9 79.48 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 118.723 0.692 . . . . 0.0 110.115 -177.308 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.422 ' HD2' ' HA ' ' A' ' 33' ' ' ASP . 63.6 mtt180 . . . . . 0 N--CA 1.471 0.583 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 177.052 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 92.8 mt . . . . . 0 N--CA 1.448 -0.538 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -122.07 156.39 33.67 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.752 1.221 . . . . 0.0 109.265 -167.729 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.477 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 14.8 m-85 -68.59 96.18 0.69 Allowed 'General case' 0 C--O 1.233 0.236 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 174.298 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 131.31 7.61 3.13 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 124.153 0.883 . . . . 0.0 113.516 -176.09 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.43 -20.56 55.98 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 116.142 1.905 . . . . 0.0 116.142 -168.39 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.565 ' H ' HG23 ' A' ' 60' ' ' VAL . 11.0 ttmt 44.59 128.54 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 130.784 3.634 . . . . 0.0 118.572 171.462 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.449 HD22 ' HB1' ' A' ' 15' ' ' ALA . 5.3 mt -127.86 151.98 48.39 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 124.605 1.162 . . . . 0.0 109.079 178.962 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 81.6 t -127.03 142.11 44.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 N-CA-C 104.959 -2.237 . . . . 0.0 104.959 163.741 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 14.3 p-10 -107.56 176.51 5.13 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 124.736 1.214 . . . . 0.0 110.872 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.23 -11.31 30.01 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.103 0.961 . . . . 0.0 112.846 -179.841 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -99.83 6.05 45.4 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.475 1.51 . . . . 0.0 110.37 179.333 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 66.25 18.32 10.9 Favored 'General case' 0 C--N 1.344 0.36 0 C-N-CA 127.158 2.183 . . . . 0.0 112.075 -178.061 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 31.1 m-70 -75.31 117.28 16.95 Favored 'General case' 0 N--CA 1.443 -0.803 0 O-C-N 120.99 -1.069 . . . . 0.0 108.892 175.525 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 57.1 m -75.49 138.02 41.3 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 169.39 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -143.5 158.0 44.0 Favored 'General case' 0 C--N 1.334 -0.105 0 C-N-CA 126.244 1.817 . . . . 0.0 111.071 177.442 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.565 HG23 ' H ' ' A' ' 50' ' ' LYS . 4.1 p -152.45 151.21 12.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 168.097 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 34.3 tp -69.38 132.7 46.8 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 127.176 2.19 . . . . 0.0 109.41 173.8 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -113.51 174.98 5.65 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.973 1.309 . . . . 0.0 109.399 178.053 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.477 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 28.4 mt-10 -64.31 -20.49 66.12 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 125.715 1.606 . . . . 0.0 113.146 -177.386 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -82.0 6.08 17.23 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.416 1.487 . . . . 0.0 111.612 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 68.03 -4.52 1.01 Allowed 'General case' 0 C--O 1.237 0.404 0 C-N-CA 128.874 2.87 . . . . 0.0 113.931 -175.171 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -77.49 168.3 20.23 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 119.378 0.99 . . . . 0.0 111.959 172.615 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.447 ' CZ3' ' HA ' ' A' ' 60' ' ' VAL . 22.2 m95 -107.99 144.02 35.86 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 107.407 -1.331 . . . . 0.0 107.407 166.831 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -134.22 151.73 76.96 Favored Pre-proline 0 C--N 1.331 -0.235 0 C-N-CA 124.557 1.143 . . . . 0.0 111.626 -167.729 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -74.71 146.95 34.62 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 124.026 3.151 . . . . 0.0 112.607 -172.398 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -135.07 36.49 3.03 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.205 1.402 . . . . 0.0 111.927 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 70.99 166.4 0.13 Allowed Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 126.519 1.928 . . . . 0.0 111.896 -177.913 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.02 176.38 9.99 Favored 'Trans proline' 0 CA--C 1.535 0.543 0 C-N-CA 121.386 1.39 . . . . 0.0 111.269 170.021 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 14.5 tp -120.77 151.35 54.41 Favored Pre-proline 0 CA--C 1.543 0.675 0 C-N-CA 125.17 1.388 . . . . 0.0 110.234 -176.774 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -73.27 163.16 38.66 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.837 2.358 . . . . 0.0 111.171 168.667 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.0 -25.17 23.17 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 122.423 2.082 . . . . 0.0 112.879 179.104 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -83.36 -19.03 36.86 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 119.132 0.878 . . . . 0.0 110.636 176.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.69 -18.2 51.7 Favored Glycine 0 CA--C 1.532 1.111 0 N-CA-C 111.269 -0.733 . . . . 0.0 111.269 171.961 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 40.3 tp -60.0 -54.06 50.47 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 124.836 1.254 . . . . 0.0 108.429 170.627 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -62.73 -24.64 67.78 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 125.501 1.521 . . . . 0.0 112.239 179.556 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 -66.91 -45.4 78.06 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 120.393 1.451 . . . . 0.0 109.874 172.818 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -67.62 -54.98 15.18 Favored 'General case' 0 C--O 1.231 0.111 0 N-CA-C 108.218 -1.031 . . . . 0.0 108.218 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 12.2 mm -55.7 -32.22 30.95 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 125.165 1.386 . . . . 0.0 110.961 -178.92 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.81 -57.04 4.63 Favored 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 124.259 1.023 . . . . 0.0 111.447 175.325 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -70.5 -34.87 72.82 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 120.341 -0.543 . . . . 0.0 111.58 -170.428 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 28.5 t60 -60.67 -53.16 60.85 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.661 0.784 . . . . 0.0 109.852 175.442 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 99.6 m -63.8 -37.91 89.15 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 118.296 -0.859 . . . . 0.0 110.484 179.52 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.06 -36.49 77.73 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 119.242 0.928 . . . . 0.0 112.402 -179.041 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 13.1 t -70.06 -32.82 71.11 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.886 0.766 . . . . 0.0 110.479 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 63.8 mt -80.03 -56.59 4.14 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.721 0.808 . . . . 0.0 109.682 177.99 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 135.19 7.83 1.91 Allowed Glycine 0 CA--C 1.539 1.548 0 C-N-CA 126.004 1.764 . . . . 0.0 114.055 -175.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 39.3 m-70 . . . . . 0 C--O 1.237 0.401 0 CA-C-N 119.956 1.878 . . . . 0.0 110.488 -179.872 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 58.8 m80 . . . . . 0 CA--C 1.54 0.584 0 N-CA-C 112.84 0.681 . . . . 0.0 112.84 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 43.1 mt -148.07 128.89 14.31 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 127.567 2.347 . . . . 0.0 106.309 -160.206 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -66.57 -46.24 76.68 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.924 0.393 . . . . 0.0 110.331 -176.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 74.3 m -153.72 174.04 15.05 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.264 1.426 . . . . 0.0 110.292 -171.158 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 38.8 t -50.41 -39.74 17.52 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 C-N-CA 126.799 2.04 . . . . 0.0 109.496 173.627 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 20.9 tpp -57.1 -40.03 76.22 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 124.186 0.994 . . . . 0.0 113.386 177.857 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -69.89 -42.1 73.86 Favored 'General case' 0 N--CA 1.463 0.177 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 177.346 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.74 -45.6 91.97 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.785 1.234 . . . . 0.0 112.381 -172.287 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 11.0 mm -58.05 -43.9 86.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -66.85 -46.43 75.1 Favored 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 124.154 0.981 . . . . 0.0 110.411 -178.546 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 36.1 t80 -53.71 -61.48 2.27 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 125.516 1.526 . . . . 0.0 110.063 177.391 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 7.2 mp -50.34 -46.76 55.92 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.154 1.382 . . . . 0.0 112.384 175.885 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -63.0 -36.77 84.66 Favored 'General case' 0 C--N 1.333 -0.142 0 O-C-N 123.323 0.39 . . . . 0.0 111.591 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -74.86 -26.13 59.46 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 118.542 -0.742 . . . . 0.0 111.584 179.252 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 29.2 mt . . . . . 0 N--CA 1.465 0.278 0 C-N-CA 124.043 0.937 . . . . 0.0 109.358 -177.331 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.446 -0.627 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.24 -55.04 0.07 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.207 0 C-N-CA 121.756 1.637 . . . . 0.0 110.883 177.125 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 19.0 t-80 -150.56 147.41 21.36 Favored Pre-proline 0 CA--C 1.534 0.338 0 C-N-CA 125.732 1.613 . . . . 0.0 107.708 -178.375 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -69.11 -38.62 8.94 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 122.795 2.33 . . . . 0.0 111.885 176.966 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.29 -17.58 61.86 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 117.901 -1.047 . . . . 0.0 112.255 -176.167 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.9 tt -58.74 122.6 13.93 Favored 'General case' 0 C--N 1.346 0.425 0 CA-C-N 118.692 0.678 . . . . 0.0 109.315 170.789 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 43.6 mm -109.95 117.43 54.66 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.257 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 176.28 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -55.17 152.51 14.88 Favored Pre-proline 0 CA--C 1.534 0.335 0 C-N-CA 123.841 0.856 . . . . 0.0 111.114 174.817 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -73.38 174.27 51.24 Favored 'Cis proline' 0 CA--C 1.535 0.541 0 C-N-CA 125.204 -0.749 . . . . 0.0 112.792 -0.382 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -138.55 173.06 11.99 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 121.234 0.54 . . . . 0.0 111.887 177.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.423 HD22 HD12 ' A' ' 25' ' ' LEU . 18.8 mt -139.78 110.38 6.71 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 126.014 1.725 . . . . 0.0 109.301 -175.997 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.8 tp -87.2 150.81 23.68 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.365 1.066 . . . . 0.0 108.303 167.852 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.13 84.84 2.06 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 119.895 1.225 . . . . 0.0 108.621 170.241 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -52.41 134.15 34.63 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 122.815 0.446 . . . . 0.0 111.273 -168.84 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -64.27 125.94 26.18 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.13 -0.941 . . . . 0.0 108.909 -168.522 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 98.29 -19.99 52.29 Favored Glycine 0 CA--C 1.527 0.815 0 CA-C-O 118.241 -1.311 . . . . 0.0 112.168 -178.405 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 2.3 t -88.85 -177.09 5.42 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 119.423 1.612 . . . . 0.0 109.989 174.263 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.1 m-80 -127.66 -12.66 5.44 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 124.644 1.178 . . . . 0.0 110.105 170.897 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -76.13 126.73 31.53 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 -176.248 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.511 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 3.5 mm? -75.51 147.32 39.85 Favored 'General case' 0 CA--C 1.52 -0.207 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 168.479 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -108.6 87.26 4.17 Favored Pre-proline 0 CA--C 1.537 0.453 0 C-N-CA 126.309 1.844 . . . . 0.0 109.081 175.057 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -66.32 113.09 2.53 Favored 'Trans proline' 0 N--CA 1.46 -0.496 0 C-N-CA 123.499 2.799 . . . . 0.0 109.901 177.899 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.2 mt -112.18 107.84 16.87 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 -177.812 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -51.65 -47.77 63.62 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 126.478 1.911 . . . . 0.0 111.587 -176.33 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.3 t -163.91 -179.25 6.16 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-O 121.949 0.88 . . . . 0.0 108.721 -168.44 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -68.33 -21.94 64.72 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 115.106 -0.952 . . . . 0.0 112.387 -175.384 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -69.85 -35.39 74.69 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 123.631 0.772 . . . . 0.0 110.626 169.224 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.8 t0 -67.03 -41.32 86.81 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 123.661 0.784 . . . . 0.0 109.423 177.673 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 75.5 t-105 -54.01 -41.06 67.57 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 121.536 -0.727 . . . . 0.0 111.193 172.684 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -71.91 -37.13 70.13 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 118.466 -0.778 . . . . 0.0 111.574 176.792 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.221 -0.436 0 CA-C-N 119.485 1.039 . . . . 0.0 109.972 172.483 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.1 mt . . . . . 0 C--O 1.235 0.314 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -140.33 163.06 33.79 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.315 1.046 . . . . 0.0 110.987 -174.759 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -76.19 70.92 2.88 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.622 1.169 . . . . 0.0 110.959 -171.32 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 152.03 18.18 0.06 OUTLIER Glycine 0 CA--C 1.524 0.6 0 CA-C-O 118.908 -0.94 . . . . 0.0 114.433 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -71.22 -17.04 62.53 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.305 1.442 . . . . 0.0 113.437 179.208 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 52.25 154.91 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 129.869 3.267 . . . . 0.0 113.454 -174.302 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.7 tp -136.73 151.62 49.43 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 106.156 -1.794 . . . . 0.0 106.156 169.153 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 39.8 t -134.46 141.03 44.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 105.359 -2.089 . . . . 0.0 105.359 163.549 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -106.15 -178.67 3.72 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.077 1.351 . . . . 0.0 111.422 176.354 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.3 t -58.75 -24.39 61.55 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.271 1.428 . . . . 0.0 112.62 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 27.4 m120 -90.23 1.04 56.9 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 124.498 1.119 . . . . 0.0 111.618 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 65.93 24.05 11.22 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.519 1.128 . . . . 0.0 111.254 -173.69 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 24.3 m170 -69.11 108.52 3.61 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 164.195 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 92.8 m -70.81 153.35 42.83 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 121.702 0.763 . . . . 0.0 109.055 164.558 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -142.86 156.33 44.91 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.334 1.454 . . . . 0.0 108.157 170.103 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 25.7 t -135.19 144.69 33.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 C-N-CA 125.667 1.587 . . . . 0.0 107.78 166.623 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 11.9 tp -75.29 129.76 37.95 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 128.859 2.864 . . . . 0.0 106.872 175.662 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -120.91 170.55 9.38 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -178.197 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -61.09 -23.52 65.55 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 123.762 0.825 . . . . 0.0 112.161 -175.457 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -74.97 4.14 7.11 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.613 1.565 . . . . 0.0 112.341 176.71 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 58.56 21.77 9.01 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 128.419 2.687 . . . . 0.0 113.517 175.826 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.6 p80 -101.65 170.54 8.11 Favored 'General case' 0 C--O 1.232 0.17 0 C-N-CA 123.971 0.908 . . . . 0.0 110.259 163.285 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 62.2 m95 -103.16 95.47 6.14 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 171.058 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 60.5 t60 -69.13 144.51 95.38 Favored Pre-proline 0 CA--C 1.54 0.572 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 178.935 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -69.82 106.48 1.68 Allowed 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 123.788 2.992 . . . . 0.0 111.386 178.692 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -81.51 37.28 0.45 Allowed 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.59 1.556 . . . . 0.0 111.895 -177.83 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 69.79 165.05 0.13 Allowed Pre-proline 0 CA--C 1.541 0.611 0 C-N-CA 128.364 2.666 . . . . 0.0 112.751 -173.811 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -74.44 168.23 25.3 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 121.336 1.357 . . . . 0.0 110.06 166.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 21.6 tp -121.33 144.3 39.6 Favored Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 124.622 1.169 . . . . 0.0 108.817 -176.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.89 167.48 27.11 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.708 2.272 . . . . 0.0 110.76 172.236 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -66.46 -35.09 31.78 Favored 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 120.791 0.994 . . . . 0.0 111.491 -175.392 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -67.48 -27.11 66.74 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.886 1.274 . . . . 0.0 110.731 174.119 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -69.49 -29.61 71.5 Favored Glycine 0 N--CA 1.444 -0.788 0 CA-C-O 119.351 -0.694 . . . . 0.0 111.655 -173.972 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 21.1 tp -51.52 -47.42 63.33 Favored 'General case' 0 C--N 1.342 0.251 0 CA-C-N 117.683 0.741 . . . . 0.0 110.158 170.983 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -58.62 -30.64 67.42 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-O 117.259 -1.353 . . . . 0.0 111.384 -173.264 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 60.8 m-20 -57.68 -37.06 72.8 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 120.302 1.41 . . . . 0.0 111.279 176.625 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -71.42 -62.14 1.52 Allowed 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 -178.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.429 HD12 HD11 ' A' ' 109' ' ' LEU . 15.9 mm -59.47 -28.12 38.99 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 122.991 0.517 . . . . 0.0 111.671 -174.25 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.5 mtm180 -48.65 -40.59 28.44 Favored 'General case' 0 C--N 1.338 0.096 0 C-N-CA 124.924 1.29 . . . . 0.0 111.619 171.071 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.48 -61.41 2.46 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.446 1.098 . . . . 0.0 110.441 177.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.511 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 7.9 t60 -52.32 -43.89 64.8 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 125.514 1.526 . . . . 0.0 110.015 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 93.8 m -68.48 -43.62 76.56 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 121.588 -0.695 . . . . 0.0 111.86 179.382 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.11 -39.18 92.74 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 118.812 0.733 . . . . 0.0 111.246 -174.737 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 12.4 t -69.33 -11.74 61.07 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 118.189 -0.91 . . . . 0.0 111.791 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 67.2 mt -125.78 -4.44 7.03 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.71 1.604 . . . . 0.0 113.231 -176.04 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 73.75 20.91 79.8 Favored Glycine 0 CA--C 1.536 1.402 0 O-C-N 120.403 -1.436 . . . . 0.0 114.501 -178.77 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' HIS . . . . . 0.514 ' NE2' HD13 ' A' ' 112' ' ' LEU . 10.1 m-70 . . . . . 0 C--O 1.243 0.719 0 CA-C-N 119.951 1.876 . . . . 0.0 112.476 -172.67 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 . . . . . 0 CA--C 1.539 0.525 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -111.24 115.25 29.03 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 126.583 1.953 . . . . 0.0 109.388 172.514 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 10.7 t-160 -58.65 -28.99 66.21 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 172.314 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 18.6 m -148.86 165.15 32.37 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.458 -0.776 . . . . 0.0 110.229 -172.023 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 40.6 t -63.11 -35.72 72.94 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 O-C-N 121.65 -0.657 . . . . 0.0 109.873 179.314 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -40.65 88.54 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 126.495 1.918 . . . . 0.0 111.233 175.464 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.59 -51.02 71.19 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 178.655 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.12 -50.91 71.82 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.057 1.343 . . . . 0.0 112.794 -176.742 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 33.9 mm -55.87 -47.92 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 CA-C-N 119.938 1.245 . . . . 0.0 109.041 -175.358 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -69.66 -40.76 76.24 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 123.954 0.902 . . . . 0.0 110.105 -172.155 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.69 ' CE2' HD11 ' A' ' 112' ' ' LEU . 73.8 t80 -52.17 -67.08 0.28 Allowed 'General case' 0 C--O 1.224 -0.237 0 C-N-CA 125.224 1.41 . . . . 0.0 109.633 171.606 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.666 ' HA ' HD12 ' A' ' 112' ' ' LEU . 7.7 mp -45.45 -45.97 13.26 Favored 'General case' 0 C--N 1.345 0.383 0 C-N-CA 124.498 1.119 . . . . 0.0 112.08 175.027 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -62.64 -39.92 95.38 Favored 'General case' 0 C--N 1.334 -0.079 0 CA-C-O 119.207 -0.425 . . . . 0.0 112.031 -178.905 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -85.7 -11.25 54.18 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 118.531 0.605 . . . . 0.0 112.497 -176.969 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.69 HD11 ' CE2' ' A' ' 108' ' ' PHE . 45.4 mt . . . . . 0 CA--C 1.517 -0.302 0 CA-C-N 118.932 0.787 . . . . 0.0 110.082 173.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.542 0.651 0 N-CA-C 111.558 0.207 . . . . 0.0 111.558 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -83.6 80.3 2.54 Favored 'Trans proline' 0 N--CA 1.448 -1.179 0 C-N-CA 122.837 2.358 . . . . 0.0 109.204 -175.423 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 75.33 149.69 0.13 Allowed Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 127.12 2.168 . . . . 0.0 110.917 -176.28 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -93.26 -18.77 0.56 Allowed 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 122.751 2.3 . . . . 0.0 112.572 174.803 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.83 -18.58 65.45 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 119.162 0.892 . . . . 0.0 110.37 169.725 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 tt -67.58 132.01 46.73 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.321 0.648 . . . . 0.0 110.683 169.603 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 40.1 mm -120.87 99.97 8.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 C-N-CA 126.822 2.049 . . . . 0.0 108.398 -174.576 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -50.06 151.16 3.63 Favored Pre-proline 0 C--O 1.235 0.335 0 C-N-CA 124.059 0.944 . . . . 0.0 112.621 179.473 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -70.48 165.49 78.56 Favored 'Cis proline' 0 CA--C 1.532 0.387 0 O-C-N 122.982 0.99 . . . . 0.0 112.754 1.524 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.463 ' HB1' HD12 ' A' ' 51' ' ' LEU . . . -140.11 172.11 13.23 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.328 0.585 . . . . 0.0 111.809 176.826 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 14.7 mt -140.36 105.83 5.08 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 127.072 2.149 . . . . 0.0 107.498 -171.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 25.9 tp -77.72 152.85 33.47 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 167.791 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.19 84.75 1.71 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.959 1.254 . . . . 0.0 113.426 176.343 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -44.89 144.59 1.14 Allowed 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 116.012 1.856 . . . . 0.0 116.012 -166.736 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -76.67 85.63 3.32 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 124.981 1.312 . . . . 0.0 109.681 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 138.21 -34.85 2.09 Favored Glycine 0 CA--C 1.524 0.643 0 C-N-CA 126.426 1.965 . . . . 0.0 110.988 175.03 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -83.38 -20.68 33.78 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 118.371 -0.823 . . . . 0.0 113.092 -163.187 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 12.8 m-80 71.64 -21.43 0.21 Allowed 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 126.811 2.044 . . . . 0.0 112.511 -179.124 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -65.47 150.38 48.45 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 125.791 1.636 . . . . 0.0 111.56 173.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.2 mt -107.22 153.47 22.64 Favored 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 126.141 1.776 . . . . 0.0 109.013 171.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -118.57 86.87 30.07 Favored Pre-proline 0 CA--C 1.537 0.447 0 C-N-CA 124.992 1.317 . . . . 0.0 109.557 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -65.08 128.18 20.06 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 123.483 2.788 . . . . 0.0 110.338 178.126 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.2 mt -134.36 113.93 12.42 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 -177.815 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 4.1 mtt85 -64.64 -46.71 81.38 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.849 0.86 . . . . 0.0 112.419 -169.351 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.551 ' H ' ' HB2' ' A' ' 33' ' ' ASP . 43.1 p -141.48 -179.92 6.43 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.931 1.293 . . . . 0.0 109.738 -178.432 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -53.62 -36.36 61.92 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 123.705 0.802 . . . . 0.0 110.752 167.79 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -65.98 -30.22 70.74 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 123.241 0.616 . . . . 0.0 110.84 -179.715 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.551 ' HB2' ' H ' ' A' ' 30' ' ' THR . 0.3 OUTLIER -70.79 -41.22 71.93 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 123.621 0.769 . . . . 0.0 109.892 174.961 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 67.6 t-105 -60.72 -42.82 98.03 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 110.5 -0.185 . . . . 0.0 110.5 173.44 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -59.42 -38.37 80.47 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 121.175 -0.953 . . . . 0.0 110.982 174.79 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.227 -0.098 0 C-N-CA 125.599 1.56 . . . . 0.0 112.826 176.894 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 19.9 mt . . . . . 0 C--O 1.234 0.27 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -108.85 149.1 29.6 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 126.482 1.913 . . . . 0.0 108.048 -179.601 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.657 ' HA ' HD13 ' A' ' 61' ' ' LEU . 57.9 m-85 -71.73 153.51 41.96 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 176.959 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.15 16.95 73.48 Favored Glycine 0 CA--C 1.531 1.067 0 CA-C-O 119.509 -0.606 . . . . 0.0 114.087 -173.71 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -59.65 -25.46 64.72 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.09 1.445 . . . . 0.0 113.283 175.264 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.7 ttmt 69.75 142.29 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 127.759 2.423 . . . . 0.0 111.006 -175.218 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.463 HD12 ' HB1' ' A' ' 15' ' ' ALA . 0.2 OUTLIER -123.68 146.81 47.96 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 105.497 -2.038 . . . . 0.0 105.497 165.348 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 72.5 t -135.28 143.71 36.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 106.343 -1.725 . . . . 0.0 106.343 170.316 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -125.3 -179.13 4.46 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.03 1.732 . . . . 0.0 111.627 -177.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.41 -19.49 65.96 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.977 1.102 . . . . 0.0 113.977 179.109 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -85.69 0.18 53.45 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 118.869 0.759 . . . . 0.0 111.065 175.188 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 54.78 31.7 16.07 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 126.16 1.784 . . . . 0.0 110.107 -168.293 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 29.6 m170 -71.23 115.21 10.11 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 120.248 -1.533 . . . . 0.0 107.151 166.276 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.2 m -77.03 147.51 36.72 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 167.186 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -135.92 159.7 40.87 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 125.014 1.325 . . . . 0.0 108.125 169.494 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 27.2 t -137.84 135.13 45.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 C-N-CA 129.061 2.944 . . . . 0.0 106.333 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.657 HD13 ' HA ' ' A' ' 47' ' ' TYR . 0.4 OUTLIER -78.27 140.02 38.87 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 175.127 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -113.49 161.16 17.69 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 123.259 0.624 . . . . 0.0 109.824 175.016 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.408 ' HA ' ' CZ ' ' A' ' 47' ' ' TYR . 2.8 mt-10 -53.15 -25.61 14.03 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.655 0.782 . . . . 0.0 112.528 -177.914 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.83 -12.15 2.87 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 129.404 3.082 . . . . 0.0 114.041 172.192 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 63.69 36.73 10.55 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-N 120.423 1.465 . . . . 0.0 110.851 -174.637 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -124.3 173.57 8.29 Favored 'General case' 0 N--CA 1.457 -0.099 0 C-N-CA 125.072 1.349 . . . . 0.0 111.161 164.375 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 70.7 m95 -115.89 121.28 41.86 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 125.074 1.35 . . . . 0.0 107.87 177.437 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -95.34 155.79 38.39 Favored Pre-proline 0 N--CA 1.439 -0.981 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 179.035 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -66.53 121.36 8.6 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 123.084 2.523 . . . . 0.0 109.094 170.64 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -108.23 40.53 1.74 Allowed 'General case' 0 C--O 1.236 0.35 0 C-N-CA 124.747 1.219 . . . . 0.0 109.987 -177.868 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.85 165.91 0.13 Allowed Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 127.136 2.174 . . . . 0.0 112.682 179.63 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -71.79 178.0 6.3 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 121.567 1.511 . . . . 0.0 111.007 166.808 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 15.7 tp -142.65 145.06 32.6 Favored Pre-proline 0 CA--C 1.535 0.369 0 C-N-CA 124.083 0.953 . . . . 0.0 111.648 -169.531 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -67.81 165.88 26.29 Favored 'Trans proline' 0 CA--C 1.536 0.617 0 C-N-CA 122.619 2.213 . . . . 0.0 113.039 176.391 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -61.77 -22.5 74.51 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 123.688 2.925 . . . . 0.0 113.257 173.795 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -86.36 -16.37 37.59 Favored 'General case' 0 C--N 1.332 -0.179 0 O-C-N 121.304 -0.872 . . . . 0.0 112.25 176.537 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -67.55 -32.89 79.78 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 120.537 -0.839 . . . . 0.0 111.958 179.326 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 35.8 tp -53.97 -58.62 6.63 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 118.054 0.927 . . . . 0.0 108.581 168.227 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -46.14 -37.69 7.27 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 126.52 1.928 . . . . 0.0 113.502 178.717 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -70.86 -37.21 73.08 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 124.583 1.153 . . . . 0.0 112.005 -177.518 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.2 tp -70.37 -51.45 29.72 Favored 'General case' 0 CA--C 1.521 -0.15 0 C-N-CA 124.866 1.266 . . . . 0.0 110.964 175.906 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 27.6 mm -57.47 -35.54 50.07 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 -177.908 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -46.22 -39.22 9.48 Favored 'General case' 0 C--O 1.224 -0.253 0 C-N-CA 124.798 1.239 . . . . 0.0 112.988 173.231 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.97 -62.27 1.98 Allowed 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 123.718 0.807 . . . . 0.0 109.599 178.857 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 42.8 t60 -57.7 -39.14 76.52 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.151 0.98 . . . . 0.0 110.723 -177.463 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 66.0 m -64.88 -41.12 95.89 Favored 'General case' 0 N--CA 1.448 -0.527 0 O-C-N 121.438 -0.789 . . . . 0.0 111.788 176.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.33 -38.27 81.37 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 124.493 1.117 . . . . 0.0 112.302 179.402 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.2 t -64.44 -40.56 95.98 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 118.895 0.77 . . . . 0.0 109.809 178.644 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 85.2 mt -82.11 -72.35 0.44 Allowed 'General case' 0 C--O 1.233 0.227 0 C-N-CA 123.819 0.848 . . . . 0.0 108.789 -176.108 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 143.61 42.19 0.06 OUTLIER Glycine 0 CA--C 1.525 0.7 0 C-N-CA 124.761 1.172 . . . . 0.0 111.212 -177.287 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 70.8 m-70 . . . . . 0 C--O 1.234 0.248 0 C-N-CA 124.136 0.974 . . . . 0.0 111.347 -174.948 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.536 0.412 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.634 HD13 ' HB2' ' A' ' 105' ' ' ALA . 97.1 mt -149.41 153.25 37.07 Favored 'General case' 0 CA--C 1.511 -0.522 0 C-N-CA 126.476 1.91 . . . . 0.0 109.279 -174.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 26.2 t-80 -76.32 -47.09 24.77 Favored 'General case' 0 N--CA 1.444 -0.728 0 C-N-CA 124.407 1.083 . . . . 0.0 112.018 167.395 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 53.9 m -170.14 179.11 3.62 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 125.461 1.504 . . . . 0.0 111.154 -171.436 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 63.8 t -66.47 -42.97 91.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 CA-C-N 119.602 1.092 . . . . 0.0 111.089 -174.875 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 4.4 tpt -56.83 -46.77 81.48 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 118.714 0.688 . . . . 0.0 109.405 -179.602 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -58.53 -36.84 74.48 Favored 'General case' 0 C--N 1.339 0.147 0 C-N-CA 124.143 0.977 . . . . 0.0 110.194 177.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.634 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -64.62 -45.73 85.63 Favored 'General case' 0 C--O 1.227 -0.131 0 C-N-CA 123.418 0.687 . . . . 0.0 111.929 178.576 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 30.1 mm -59.03 -47.78 88.82 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 -177.019 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -75.82 -32.04 59.65 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 118.834 -0.603 . . . . 0.0 111.31 -177.328 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -60.18 -56.4 22.02 Favored 'General case' 0 C--N 1.342 0.25 0 C-N-CA 123.922 0.889 . . . . 0.0 110.202 173.577 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 25.3 mt -57.6 -43.25 84.55 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -175.512 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -68.86 -7.69 36.87 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 175.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -107.03 -7.95 16.74 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 119.817 1.19 . . . . 0.0 112.601 176.222 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . 0.293 1.3 tp . . . . . 0 N--CA 1.416 -2.151 0 C-N-CA 126.472 1.909 . . . . 0.0 109.063 -177.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 6.8 p . . . . . 0 C--O 1.239 0.518 0 N-CA-C 110.572 -0.158 . . . . 0.0 110.572 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -68.18 -55.37 0.25 Allowed 'Trans proline' 0 N--CA 1.45 -1.081 0 C-N-CA 121.699 1.599 . . . . 0.0 110.842 169.432 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -140.45 153.88 68.91 Favored Pre-proline 0 CA--C 1.542 0.65 0 C-N-CA 126.949 2.1 . . . . 0.0 108.481 177.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -85.25 -17.94 4.32 Favored 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 122.75 2.3 . . . . 0.0 113.513 173.836 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -78.82 -17.61 55.41 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 118.905 0.775 . . . . 0.0 112.278 -179.054 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.405 HD12 ' HB3' ' A' ' 53' ' ' ASP . 0.6 OUTLIER -66.99 135.22 53.42 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.455 0.702 . . . . 0.0 111.013 165.224 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 47.9 mm -123.07 108.02 20.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 C-N-CA 127.27 2.228 . . . . 0.0 106.892 176.483 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 56.6 m95 -52.6 151.99 7.19 Favored Pre-proline 0 C--O 1.238 0.473 0 C-N-CA 124.68 1.192 . . . . 0.0 111.644 -179.215 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -69.69 169.44 63.06 Favored 'Cis proline' 0 N--CA 1.457 -0.658 0 N-CA-C 115.411 1.274 . . . . 0.0 115.411 -0.371 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.78 171.23 14.71 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.596 1.159 . . . . 0.0 111.392 -175.152 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -146.53 102.78 3.61 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.514 1.125 . . . . 0.0 111.04 -165.303 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.9 tp -78.32 150.32 33.3 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 123.35 0.66 . . . . 0.0 109.23 177.837 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.401 ' O ' ' HE2' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -150.7 84.98 1.36 Allowed 'General case' 0 C--O 1.237 0.416 0 CA-C-N 119.082 0.855 . . . . 0.0 110.574 174.404 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -59.76 158.59 10.11 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 123.565 0.746 . . . . 0.0 110.762 -167.581 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -67.22 125.33 25.72 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 122.836 1.303 . . . . 0.0 111.135 178.288 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 85.75 -31.96 3.82 Favored Glycine 0 CA--C 1.528 0.871 0 C-N-CA 125.692 1.615 . . . . 0.0 111.904 178.534 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 39.4 m -68.14 169.19 10.7 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 118.448 1.124 . . . . 0.0 110.077 170.609 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -141.1 -16.4 0.85 Allowed 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 125.265 1.426 . . . . 0.0 111.958 -175.021 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -71.03 105.94 3.51 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 175.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.474 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 3.9 mm? -60.37 137.86 58.07 Favored 'General case' 0 N--CA 1.462 0.162 0 N-CA-C 106.903 -1.518 . . . . 0.0 106.903 171.498 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.56 88.12 8.9 Favored Pre-proline 0 C--N 1.33 -0.261 0 C-N-CA 125.308 1.443 . . . . 0.0 107.864 -174.648 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -62.54 132.06 36.39 Favored 'Trans proline' 0 CA--C 1.541 0.829 0 C-N-CA 123.208 2.605 . . . . 0.0 109.994 176.919 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -119.4 118.05 30.13 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 106.105 -1.813 . . . . 0.0 106.105 168.768 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 72.7 mtm180 -75.03 -47.02 31.11 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 -174.237 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 67.4 p -135.59 178.59 6.92 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.815 0.846 . . . . 0.0 110.903 -179.258 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -60.03 -39.5 86.12 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.452 -0.78 . . . . 0.0 109.582 175.387 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -56.66 -23.81 44.17 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.459 1.104 . . . . 0.0 111.371 176.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -93.86 -32.51 13.9 Favored 'General case' 0 N--CA 1.454 -0.272 0 O-C-N 120.756 -1.215 . . . . 0.0 111.058 -172.905 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 11.0 t-105 -58.06 -42.83 86.3 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 165.95 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -53.53 -60.29 3.5 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 172.432 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.508 0 C-N-CA 117.556 -1.658 . . . . 0.0 110.204 -163.546 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 48.5 mt . . . . . 0 C--O 1.234 0.252 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -142.78 163.61 32.34 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 125.941 1.696 . . . . 0.0 107.54 -178.012 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.481 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 20.6 m-85 -55.95 138.23 49.2 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.77 0.795 . . . . 0.0 110.67 -179.108 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.28 7.69 76.15 Favored Glycine 0 CA--C 1.536 1.384 0 CA-C-O 118.096 -1.391 . . . . 0.0 114.244 179.181 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.97 -27.17 61.02 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 119.716 1.758 . . . . 0.0 115.483 -170.487 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.476 ' H ' HG23 ' A' ' 60' ' ' VAL . 22.0 ttmt 57.62 152.2 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 130.38 3.472 . . . . 0.0 115.791 174.847 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.4 tp -141.19 155.58 46.04 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 174.739 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 97.0 t -130.58 155.43 41.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 105.105 -2.183 . . . . 0.0 105.105 157.677 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.405 ' HB3' HD12 ' A' ' 11' ' ' LEU . 2.0 p-10 -123.5 -179.74 4.45 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 126.521 1.928 . . . . 0.0 111.76 176.512 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.5 m -68.55 -17.12 64.08 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 114.857 1.428 . . . . 0.0 114.857 177.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -77.36 -7.81 56.68 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 120.433 1.469 . . . . 0.0 111.27 168.959 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 64.66 32.28 11.44 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.885 1.274 . . . . 0.0 110.713 -167.328 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 54.1 m170 -83.61 110.3 18.13 Favored 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 166.398 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.5 m -79.67 149.18 31.33 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 169.78 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -146.64 164.81 31.49 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 125.448 1.499 . . . . 0.0 110.623 176.385 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.476 HG23 ' H ' ' A' ' 50' ' ' LYS . 7.6 p -153.72 150.89 11.97 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 CA-C-N 120.372 1.442 . . . . 0.0 113.871 170.028 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.433 HD12 ' O ' ' A' ' 66' ' ' HIS . 38.6 tp -72.19 135.62 46.17 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.744 2.017 . . . . 0.0 109.301 176.34 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -116.25 -179.74 3.76 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.313 1.045 . . . . 0.0 109.27 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.481 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 14.7 mp0 -60.32 -20.96 61.34 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.885 1.274 . . . . 0.0 113.826 -177.305 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -90.91 16.44 9.45 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.416 1.086 . . . . 0.0 112.552 -173.277 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 61.38 -0.57 0.36 Allowed 'General case' 0 C--O 1.239 0.547 0 C-N-CA 126.855 2.062 . . . . 0.0 114.075 -172.703 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.433 ' O ' HD12 ' A' ' 61' ' ' LEU . 0.9 OUTLIER -82.29 171.99 13.62 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 118.864 0.756 . . . . 0.0 111.164 176.379 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.416 ' CE2' ' HB2' ' A' ' 61' ' ' LEU . 26.2 m95 -115.57 147.14 41.07 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 168.748 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -134.55 162.87 55.13 Favored Pre-proline 0 CA--C 1.532 0.256 0 C-N-CA 125.272 1.429 . . . . 0.0 111.272 -169.013 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -72.19 133.15 20.68 Favored 'Trans proline' 0 CA--C 1.535 0.548 0 C-N-CA 123.5 2.8 . . . . 0.0 112.587 -176.421 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -114.46 29.52 7.96 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.999 1.32 . . . . 0.0 111.432 175.099 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 70.05 165.35 0.13 Allowed Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 127.615 2.366 . . . . 0.0 111.899 -178.242 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -70.43 173.01 12.2 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 121.207 1.271 . . . . 0.0 110.259 168.71 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 12.6 tp -127.19 144.29 50.09 Favored Pre-proline 0 CA--C 1.533 0.322 0 CA-C-O 117.755 -1.117 . . . . 0.0 108.569 -178.698 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -76.02 169.36 22.27 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 122.761 2.307 . . . . 0.0 110.19 173.515 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -63.02 -30.31 76.15 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 121.889 1.726 . . . . 0.0 112.918 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -82.1 -21.52 36.71 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 119.385 0.993 . . . . 0.0 111.459 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.22 -16.28 57.72 Favored Glycine 0 CA--C 1.534 1.247 0 O-C-N 121.872 -0.518 . . . . 0.0 112.457 178.598 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 23.8 tp -61.04 -52.55 64.51 Favored 'General case' 0 C--O 1.232 0.148 0 C-N-CA 126.133 1.773 . . . . 0.0 109.592 172.843 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -71.65 -34.13 69.49 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 125.306 1.442 . . . . 0.0 109.088 -169.805 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -52.57 -48.44 66.19 Favored 'General case' 0 CA--C 1.516 -0.333 0 C-N-CA 126.185 1.794 . . . . 0.0 112.081 172.169 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 28.9 mt -65.01 -58.2 6.72 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.416 177.846 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.486 HD12 HD11 ' A' ' 109' ' ' LEU . 16.4 mm -58.86 -25.0 27.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.339 0 CA-C-O 118.952 -0.546 . . . . 0.0 111.984 -175.579 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 5.7 ttm180 -46.32 -40.37 11.67 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-O 117.909 -1.043 . . . . 0.0 111.523 173.104 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -67.29 -45.85 75.32 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 119.385 0.993 . . . . 0.0 112.041 -178.671 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.474 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 10.9 t60 -61.96 -45.43 93.68 Favored 'General case' 0 C--O 1.223 -0.3 0 C-N-CA 124.473 1.109 . . . . 0.0 109.318 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 99.1 m -69.42 -46.11 67.59 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 121.548 -0.72 . . . . 0.0 110.657 -179.137 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.23 -44.72 95.91 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 118.392 -0.813 . . . . 0.0 110.861 -177.263 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 8.4 t -67.25 -17.86 64.97 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 117.986 -1.007 . . . . 0.0 112.181 -175.198 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 83.7 mt -110.64 -35.31 6.04 Favored 'General case' 0 C--N 1.341 0.222 0 CA-C-N 119.097 0.862 . . . . 0.0 111.524 -172.593 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 115.18 17.91 6.52 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.975 1.274 . . . . 0.0 113.293 -179.33 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' HIS . . . . . 0.597 ' CD2' HD13 ' A' ' 112' ' ' LEU . 4.8 m-70 . . . . . 0 C--O 1.242 0.681 0 CA-C-N 118.404 1.102 . . . . 0.0 111.556 -173.898 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 8.6 t-160 . . . . . 0 CA--C 1.533 0.318 0 N-CA-C 113.569 0.951 . . . . 0.0 113.569 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 18.4 mt -141.97 118.63 11.03 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 -161.064 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 13.0 t-160 -69.76 -43.08 72.97 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 118.323 0.51 . . . . 0.0 110.941 172.797 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 67.5 m -145.23 166.89 24.17 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 124.337 1.055 . . . . 0.0 110.199 -164.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 70.4 t -55.35 -35.7 37.86 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 169.42 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 2.8 tpt -52.76 -47.48 67.43 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 125.151 1.38 . . . . 0.0 112.024 175.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -59.06 -50.86 72.48 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.86 -48.83 78.76 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 125.112 1.365 . . . . 0.0 112.83 -172.445 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 19.9 mm -58.72 -45.1 91.2 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 -176.534 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -67.58 -43.0 81.63 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 122.725 0.41 . . . . 0.0 111.135 -178.81 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 44.6 t80 -50.18 -60.1 3.29 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.429 1.091 . . . . 0.0 110.246 176.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.486 HD11 HD12 ' A' ' 82' ' ' ILE . 9.0 mp -54.77 -45.79 74.31 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 125.04 1.336 . . . . 0.0 111.933 175.026 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -61.16 -31.57 71.3 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 119.606 -0.235 . . . . 0.0 111.515 -179.042 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -78.16 -18.58 55.38 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.923 0.889 . . . . 0.0 112.4 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.597 HD13 ' CD2' ' A' ' 91' ' ' HIS . 47.0 mt . . . . . 0 C--O 1.233 0.204 0 C-N-CA 124.955 1.302 . . . . 0.0 111.104 -177.613 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.474 0.747 0 CA-C-O 119.231 -0.414 . . . . 0.0 111.462 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.45 -47.43 0.18 Allowed 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.558 2.172 . . . . 0.0 111.595 177.349 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 16.4 t-80 -147.62 148.14 29.91 Favored Pre-proline 0 C--O 1.235 0.311 0 C-N-CA 126.882 2.073 . . . . 0.0 106.738 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -75.91 -32.95 4.05 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 121.318 1.345 . . . . 0.0 112.843 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -84.61 -4.43 58.99 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 117.872 -1.061 . . . . 0.0 112.713 179.369 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 tt -66.97 127.68 33.47 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 119.786 1.176 . . . . 0.0 108.09 165.03 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 24.1 mm -115.26 119.56 62.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 -177.156 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 75.7 m95 -63.66 152.91 85.12 Favored Pre-proline 0 CA--C 1.538 0.491 0 C-N-CA 123.441 0.696 . . . . 0.0 111.749 -177.021 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -74.36 168.89 75.57 Favored 'Cis proline' 0 CA--C 1.532 0.422 0 N-CA-C 113.376 0.491 . . . . 0.0 113.376 -0.155 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -126.97 166.88 16.7 Favored 'General case' 0 CA--C 1.521 -0.151 0 C-N-CA 124.024 0.929 . . . . 0.0 111.258 178.697 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 12.9 mt -143.26 102.37 3.96 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 126.186 1.795 . . . . 0.0 107.051 -178.473 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.9 tp -78.51 138.08 38.24 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 170.618 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.55 91.63 2.81 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 106.608 -1.626 . . . . 0.0 106.608 170.868 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -55.93 147.79 18.7 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 124.005 0.816 . . . . 0.0 111.974 -174.717 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -73.5 97.12 2.51 Favored 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 124.731 1.212 . . . . 0.0 110.345 -178.366 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 133.76 -49.43 0.91 Allowed Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 126.282 1.896 . . . . 0.0 108.978 -177.452 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 35.8 m -65.41 172.96 2.87 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 124.827 1.251 . . . . 0.0 111.076 -178.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 18.0 m-80 -129.29 -31.2 2.09 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 124.736 1.215 . . . . 0.0 109.302 175.376 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -67.27 95.71 0.44 Allowed 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 128.19 2.596 . . . . 0.0 108.963 -175.746 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.428 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 3.1 mm? -53.36 143.61 18.5 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.734 0.813 . . . . 0.0 109.819 178.537 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.402 ' HA ' ' HD2' ' A' ' 27' ' ' PRO . 1.4 tm? -111.97 87.42 8.65 Favored Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 125.705 1.602 . . . . 0.0 108.603 173.235 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.402 ' HD2' ' HA ' ' A' ' 26' ' ' LEU . 57.6 Cg_endo -62.55 136.81 60.78 Favored 'Trans proline' 0 CA--C 1.535 0.546 1 C-N-CA 125.712 4.275 . . . . 0.0 111.75 174.164 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -124.14 114.79 20.14 Favored 'General case' 0 N--CA 1.462 0.134 0 C-N-CA 125.961 1.704 . . . . 0.0 108.244 170.567 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.6 mmm180 -62.35 -56.21 20.61 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 126.057 1.743 . . . . 0.0 109.995 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 61.6 p -139.05 -178.21 5.24 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 124.353 1.061 . . . . 0.0 108.621 178.81 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -59.67 -29.54 68.14 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.505 -0.747 . . . . 0.0 111.885 167.099 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -61.67 -23.44 66.09 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.68 0.792 . . . . 0.0 111.168 175.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -84.45 -46.79 11.3 Favored 'General case' 0 C--O 1.223 -0.293 0 C-N-CA 126.335 1.854 . . . . 0.0 109.754 177.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 39.0 t-105 -55.48 -38.5 69.21 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 120.776 -1.203 . . . . 0.0 110.982 175.636 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 4.4 mm100 -61.34 -43.07 99.49 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.599 1.16 . . . . 0.0 111.85 172.84 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 69.5 mtt85 . . . . . 0 CA--C 1.518 -0.281 0 CA-C-O 118.572 -0.727 . . . . 0.0 110.988 176.514 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.8 mt . . . . . 0 C--O 1.24 0.563 0 N-CA-C 105.988 -1.856 . . . . 0.0 105.988 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -136.07 163.99 29.05 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 124.039 0.936 . . . . 0.0 111.591 -168.525 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.401 ' CZ ' ' HA ' ' A' ' 63' ' ' GLU . 3.0 m-85 -69.0 109.86 4.17 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 106.722 -1.584 . . . . 0.0 106.722 -172.051 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.526 ' HA2' HG13 ' A' ' 60' ' ' VAL . . . 116.18 -4.71 20.12 Favored Glycine 0 CA--C 1.528 0.879 0 CA-C-O 117.62 -1.655 . . . . 0.0 114.805 -178.177 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -68.99 -2.64 10.39 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-N 120.703 2.251 . . . . 0.0 116.164 -169.829 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 9.6 ttmt 51.45 119.0 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 131.56 3.944 . . . . 0.0 116.473 167.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 10.3 mt -106.78 149.27 27.51 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 107.81 -1.182 . . . . 0.0 107.81 165.337 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 55.4 t -131.31 148.08 32.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 104.556 -2.386 . . . . 0.0 104.556 167.58 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -127.79 175.3 8.43 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 131.471 3.908 . . . . 0.0 110.36 -169.492 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.0 p -58.71 -35.19 72.26 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.803 0.841 . . . . 0.0 112.896 -179.12 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 40.6 m-20 -83.02 -0.43 48.85 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.657 1.583 . . . . 0.0 113.49 -176.26 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 62.64 22.06 13.09 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 120.028 1.286 . . . . 0.0 111.38 -177.603 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 34.7 m170 -71.02 103.85 2.82 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 119.85 -1.781 . . . . 0.0 110.086 160.497 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.07 146.44 54.18 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 120.108 1.322 . . . . 0.0 107.682 171.113 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -134.3 149.25 50.88 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 124.629 1.172 . . . . 0.0 108.091 174.39 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.526 HG13 ' HA2' ' A' ' 48' ' ' GLY . 37.1 t -137.01 140.11 43.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 C-N-CA 126.798 2.039 . . . . 0.0 106.915 175.587 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 27.9 tp -72.0 138.95 48.33 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 125.738 1.615 . . . . 0.0 107.995 173.641 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -109.86 168.94 9.05 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 124.32 1.048 . . . . 0.0 110.292 178.601 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.401 ' HA ' ' CZ ' ' A' ' 47' ' ' TYR . 16.4 mp0 -60.27 -37.65 81.12 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.866 0.867 . . . . 0.0 110.571 178.357 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -73.48 10.66 0.97 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.95 1.3 . . . . 0.0 113.264 176.611 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 74.14 7.58 4.72 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 127.803 2.441 . . . . 0.0 114.532 164.624 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 2.3 p80 -92.17 168.3 11.45 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.55 1.14 . . . . 0.0 110.296 170.949 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 58.5 m95 -105.13 96.84 6.8 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 108.177 -1.045 . . . . 0.0 108.177 175.579 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 53.4 t-80 -69.88 144.39 93.2 Favored Pre-proline 0 CA--C 1.543 0.708 0 CA-C-N 118.013 0.369 . . . . 0.0 110.006 179.451 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -69.4 103.03 1.04 Allowed 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 124.49 3.46 . . . . 0.0 111.262 171.536 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -83.45 37.01 0.55 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.293 1.837 . . . . 0.0 112.395 -178.293 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 67.59 165.28 0.12 Allowed Pre-proline 0 CA--C 1.546 0.809 0 C-N-CA 128.002 2.521 . . . . 0.0 112.716 178.636 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -72.71 174.65 11.42 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 121.526 1.484 . . . . 0.0 113.176 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.6 tt -131.49 143.73 50.42 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 127.157 2.183 . . . . 0.0 108.406 -168.553 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -89.43 166.47 5.29 Favored 'Trans proline' 0 CA--C 1.538 0.725 0 C-N-CA 124.065 3.177 . . . . 0.0 112.396 -178.586 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -58.19 -19.58 42.59 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.898 2.399 . . . . 0.0 113.93 178.607 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -101.56 -17.41 16.4 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 124.127 0.971 . . . . 0.0 111.086 -177.025 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.53 -40.37 98.67 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.135 -1.186 . . . . 0.0 110.135 174.878 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 54.6 tp -60.83 -50.21 74.35 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 179.018 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -63.61 -19.64 65.02 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.638 1.175 . . . . 0.0 111.793 -177.391 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -77.43 -47.13 20.54 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 119.696 1.135 . . . . 0.0 110.793 170.741 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 29.4 mt -57.63 -54.46 46.58 Favored 'General case' 0 N--CA 1.466 0.367 0 O-C-N 121.807 -0.558 . . . . 0.0 110.305 174.771 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 20.2 mm -58.11 -33.1 45.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 C-N-CA 125.084 1.354 . . . . 0.0 110.443 -178.249 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.86 -33.73 37.63 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 119.081 0.855 . . . . 0.0 111.729 174.369 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.4 -54.43 40.43 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 119.159 0.89 . . . . 0.0 110.472 -177.291 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.442 ' HE2' HD12 ' A' ' 112' ' ' LEU . 8.6 t60 -64.15 -39.33 93.8 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.478 0.711 . . . . 0.0 109.941 179.072 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 80.6 m -70.2 -40.82 74.37 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 121.327 -0.858 . . . . 0.0 111.405 -178.015 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -75.92 -31.06 58.96 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 118.925 0.784 . . . . 0.0 111.884 -177.262 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.8 t -66.1 -40.67 90.95 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 176.2 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 98.0 mt -81.16 -70.7 0.51 Allowed 'General case' 0 C--N 1.341 0.238 0 CA-C-O 118.596 -0.716 . . . . 0.0 109.256 -176.294 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 153.2 39.63 0.02 OUTLIER Glycine 0 CA--C 1.53 0.989 0 CA-C-O 118.572 -1.127 . . . . 0.0 113.768 171.788 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.541 0.629 0 CA-C-N 118.938 1.369 . . . . 0.0 111.841 -172.035 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.548 0.874 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.638 HD13 ' HB2' ' A' ' 105' ' ' ALA . 81.3 mt -144.47 171.24 14.63 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 128.385 2.674 . . . . 0.0 110.126 -157.063 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 29.7 t-80 -106.48 -27.16 11.08 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 126.217 1.807 . . . . 0.0 112.156 176.158 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 3.0 m -172.86 172.79 3.96 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.139 1.376 . . . . 0.0 111.392 -172.804 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 34.7 t -66.56 -44.66 89.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 175.415 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 51.2 tpp -56.99 -40.11 75.95 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.398 -0.814 . . . . 0.0 111.506 178.886 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -69.11 -31.33 69.95 Favored 'General case' 0 C--O 1.233 0.195 0 O-C-N 122.17 -0.331 . . . . 0.0 110.85 179.318 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.638 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -64.24 -46.87 81.88 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.656 1.182 . . . . 0.0 110.043 173.042 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 42.4 mm -56.68 -37.45 52.9 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.215 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 176.103 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.46 -47.35 61.03 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 119.331 0.968 . . . . 0.0 111.399 177.176 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -54.41 -55.2 31.14 Favored 'General case' 0 N--CA 1.461 0.083 0 C-N-CA 125.563 1.545 . . . . 0.0 111.57 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 63.7 mt -62.72 -34.86 78.04 Favored 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 124.527 1.131 . . . . 0.0 110.721 -173.218 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -74.18 -44.22 54.28 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 124.293 1.037 . . . . 0.0 110.251 -176.961 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -64.88 2.5 0.7 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.608 1.563 . . . . 0.0 114.2 178.794 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.442 HD12 ' HE2' ' A' ' 85' ' ' HIS . 69.7 mt . . . . . 0 CA--C 1.529 0.143 0 C-N-CA 124.216 1.006 . . . . 0.0 112.1 169.179 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.238 0.47 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -67.72 -49.27 1.18 Allowed 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.685 2.257 . . . . 0.0 112.002 175.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 4.5 t-80 -158.77 144.88 12.41 Favored Pre-proline 0 CA--C 1.534 0.332 0 CA-C-O 117.645 -1.169 . . . . 0.0 110.81 -175.195 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -72.24 -20.58 24.43 Favored 'Trans proline' 0 CA--C 1.534 0.486 0 C-N-CA 123.157 2.571 . . . . 0.0 112.96 175.001 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -85.03 -9.4 58.05 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.282 -0.886 . . . . 0.0 111.9 176.931 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.3 tt -78.67 132.21 36.95 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 123.957 0.903 . . . . 0.0 109.713 170.658 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 24.1 mm -120.53 114.11 42.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 176.903 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -56.5 153.8 19.28 Favored Pre-proline 0 C--O 1.238 0.456 0 CA-C-O 118.874 -0.584 . . . . 0.0 111.642 178.985 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -68.56 172.16 45.33 Favored 'Cis proline' 0 CA--C 1.535 0.563 0 N-CA-C 114.195 0.806 . . . . 0.0 114.195 -1.998 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -136.2 171.63 14.19 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.521 0.728 . . . . 0.0 112.132 176.105 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 14.5 mt -143.38 108.32 4.93 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 127.555 2.342 . . . . 0.0 106.901 -177.634 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.6 tp -83.3 148.38 27.4 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 170.369 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.66 90.26 1.91 Allowed 'General case' 0 C--O 1.238 0.499 0 CA-C-N 119.739 1.154 . . . . 0.0 109.759 171.07 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.425 HE21 ' CG ' ' A' ' 49' ' ' ASP . 4.8 mt-30 -48.98 152.48 1.05 Allowed 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 125.687 1.595 . . . . 0.0 111.932 -172.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -70.16 -11.18 60.71 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.835 0.68 . . . . 0.0 112.835 173.686 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -95.79 -17.66 34.86 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 124.995 1.283 . . . . 0.0 113.57 -178.675 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 1.3 m -129.81 -176.48 3.93 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 119.254 1.527 . . . . 0.0 110.583 -171.81 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -132.21 -19.47 2.5 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 126.352 1.861 . . . . 0.0 110.612 -176.004 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -67.68 155.36 39.39 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 167.727 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.3 mt -102.0 165.11 11.35 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 125.079 1.352 . . . . 0.0 108.937 172.456 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -118.19 88.33 32.11 Favored Pre-proline 0 C--N 1.328 -0.346 0 C-N-CA 125.774 1.63 . . . . 0.0 108.468 171.413 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -62.2 128.59 24.37 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 122.682 2.255 . . . . 0.0 110.225 173.039 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -120.56 109.07 14.82 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.15 1.38 . . . . 0.0 108.056 172.62 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 79.0 mtm180 -66.14 -47.79 72.91 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 125.344 1.458 . . . . 0.0 113.048 -173.939 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.14 168.11 22.44 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 126.351 1.86 . . . . 0.0 106.508 -177.468 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 -53.56 -33.28 54.15 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 126.24 1.816 . . . . 0.0 113.628 -176.125 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -56.53 -35.29 67.92 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.49 1.516 . . . . 0.0 111.575 175.298 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -66.67 -47.27 73.01 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.264 1.826 . . . . 0.0 109.891 -177.273 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 36.1 t-105 -61.88 -41.27 97.68 Favored 'General case' 0 C--N 1.345 0.38 0 O-C-N 120.771 -1.206 . . . . 0.0 110.719 176.264 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -59.56 -54.79 42.51 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 175.147 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 61.7 mtp180 . . . . . 0 C--O 1.226 -0.147 0 CA-C-O 117.656 -1.164 . . . . 0.0 112.408 179.557 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 36.1 mt . . . . . 0 N--CA 1.468 0.46 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -144.83 150.38 37.03 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 121.85 0.833 . . . . 0.0 110.647 -166.787 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.423 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 3.4 m-85 -62.13 130.1 43.88 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 173.508 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 100.55 5.87 53.54 Favored Glycine 0 CA--C 1.527 0.833 0 CA-C-O 118.441 -1.199 . . . . 0.0 114.301 -176.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.425 ' CG ' HE21 ' A' ' 19' ' ' GLN . 5.4 m-20 -75.71 -6.76 52.07 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 115.905 1.817 . . . . 0.0 115.905 -166.775 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 16.2 ttmt 53.07 130.71 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 130.238 3.415 . . . . 0.0 116.692 173.486 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 5.9 tp -122.02 154.76 36.83 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 175.402 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 41.0 t -138.04 131.6 41.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 C-N-CA 126.587 1.955 . . . . 0.0 107.0 175.082 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -107.14 -178.75 3.73 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.446 1.498 . . . . 0.0 113.41 178.689 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.436 ' HA ' HG21 ' A' ' 102' ' ' VAL . 8.6 t -56.72 -13.94 2.91 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 128.385 2.674 . . . . 0.0 115.103 177.596 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -122.69 11.87 9.84 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 126.823 2.049 . . . . 0.0 109.733 -173.64 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 66.96 16.43 10.36 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.895 1.678 . . . . 0.0 110.589 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 25.0 m170 -61.45 108.53 0.96 Allowed 'General case' 0 C--O 1.24 0.565 0 CA-C-N 120.363 1.438 . . . . 0.0 107.995 168.506 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -82.29 149.42 27.8 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 173.556 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -138.55 164.49 29.3 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 171.087 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 25.6 t -133.27 138.78 50.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 C-N-CA 128.087 2.555 . . . . 0.0 106.425 172.188 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 16.0 tp -80.16 137.32 36.68 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 171.155 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -121.84 170.91 9.31 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.38 1.072 . . . . 0.0 110.371 174.762 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.625 ' H ' ' CD ' ' A' ' 63' ' ' GLU . 0.7 OUTLIER -66.99 -18.57 65.45 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.584 1.553 . . . . 0.0 111.433 -171.086 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -78.16 16.45 0.76 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.903 1.281 . . . . 0.0 110.958 172.229 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 61.45 0.97 0.5 Allowed 'General case' 0 C--O 1.239 0.549 0 C-N-CA 129.746 3.219 . . . . 0.0 114.979 176.789 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 2.2 p-80 -85.12 156.49 21.03 Favored 'General case' 0 N--CA 1.437 -1.105 0 CA-C-O 121.781 0.801 . . . . 0.0 109.269 175.738 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 81.4 m95 -83.93 142.52 30.48 Favored 'General case' 0 N--CA 1.437 -1.077 0 N-CA-C 104.801 -2.296 . . . . 0.0 104.801 153.863 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 65.8 t60 -114.1 143.99 30.76 Favored Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 171.663 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.78 103.3 0.98 Allowed 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 124.574 3.516 . . . . 0.0 111.058 176.87 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -79.6 29.91 0.24 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.705 1.602 . . . . 0.0 111.857 177.516 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 66.5 165.47 0.12 Allowed Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 128.156 2.583 . . . . 0.0 111.705 -173.939 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -63.36 170.23 8.34 Favored 'Trans proline' 0 N--CA 1.45 -1.034 0 C-N-CA 121.179 1.253 . . . . 0.0 110.864 167.574 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 13.4 tp -123.82 145.83 48.82 Favored Pre-proline 0 C--O 1.237 0.421 0 C-N-CA 124.519 1.127 . . . . 0.0 109.211 -174.346 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -61.46 158.78 34.6 Favored 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 123.33 2.686 . . . . 0.0 111.484 174.767 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -59.2 -27.23 84.45 Favored 'Trans proline' 0 N--CA 1.457 -0.674 0 C-N-CA 122.634 2.223 . . . . 0.0 112.398 179.159 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -96.11 -12.37 24.88 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.599 0.76 . . . . 0.0 111.102 -173.694 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.43 -28.12 68.37 Favored Glycine 0 CA--C 1.527 0.833 0 C-N-CA 123.807 0.718 . . . . 0.0 111.753 175.878 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 36.4 tp -52.95 -59.23 4.78 Favored 'General case' 0 C--N 1.34 0.158 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 165.43 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -62.59 -20.13 64.42 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.898 1.279 . . . . 0.0 112.13 -169.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -75.48 -44.94 41.35 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.577 1.151 . . . . 0.0 111.141 172.386 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 41.4 mt -61.65 -44.09 97.63 Favored 'General case' 0 C--O 1.234 0.257 0 O-C-N 121.009 -1.057 . . . . 0.0 110.08 173.664 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 37.0 mm -56.95 -41.52 77.02 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 123.25 0.62 . . . . 0.0 109.514 173.154 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -50.38 -42.83 54.0 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 124.413 1.085 . . . . 0.0 112.309 -179.18 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -67.44 -43.63 80.66 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 119.1 0.864 . . . . 0.0 110.952 -179.109 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 -58.68 -46.38 87.36 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 177.356 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 30.5 m -60.41 -44.31 95.84 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-O 118.361 -0.828 . . . . 0.0 111.244 175.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -71.48 -27.78 63.47 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 117.623 -1.179 . . . . 0.0 112.094 -172.072 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 8.4 t -70.86 -40.77 72.11 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 119.984 1.266 . . . . 0.0 108.872 177.699 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 58.8 mt -89.47 -63.5 1.28 Allowed 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 -174.476 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 157.7 9.57 0.05 OUTLIER Glycine 0 CA--C 1.536 1.351 0 C-N-CA 125.412 1.482 . . . . 0.0 114.428 174.755 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 21.6 p80 . . . . . 0 N--CA 1.468 0.474 0 CA-C-N 120.354 2.077 . . . . 0.0 114.237 -150.771 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.543 0.699 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.416 HD13 ' CB ' ' A' ' 105' ' ' ALA . 75.2 mt -142.67 141.3 31.84 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 126.643 1.977 . . . . 0.0 109.37 -169.246 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 9.8 t-160 -75.75 -27.22 58.01 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.063 0.545 . . . . 0.0 112.082 -174.5 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 11.2 p 179.69 179.56 0.49 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.191 1.396 . . . . 0.0 109.692 -174.476 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.436 HG21 ' HA ' ' A' ' 54' ' ' SER . 6.5 t -64.65 -45.53 95.09 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.21 0 C-N-CA 123.58 0.752 . . . . 0.0 109.054 -178.849 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 6.7 tpt -62.98 -32.82 74.25 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 121.727 -0.608 . . . . 0.0 110.682 -177.296 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.76 -37.84 70.46 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.186 0.994 . . . . 0.0 109.491 177.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.416 ' CB ' HD13 ' A' ' 99' ' ' LEU . . . -63.74 -43.15 97.35 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 125.635 1.574 . . . . 0.0 112.455 176.159 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 33.9 mm -61.26 -50.63 79.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -179.503 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -66.34 -39.16 89.02 Favored 'General case' 0 C--O 1.226 -0.177 0 O-C-N 123.369 0.418 . . . . 0.0 110.326 -176.798 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -53.91 -56.37 18.36 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 124.548 1.139 . . . . 0.0 111.117 172.715 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 31.7 mt -62.43 -38.78 91.04 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 111.761 0.282 . . . . 0.0 111.761 -177.565 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -64.87 -41.41 95.69 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 177.244 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -70.33 -13.35 62.11 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 118.111 -0.947 . . . . 0.0 113.161 -178.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 94.9 mt . . . . . 0 N--CA 1.463 0.187 0 CA-C-N 120.082 1.31 . . . . 0.0 110.934 172.456 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.544 0.733 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -77.92 -165.08 0.31 Allowed 'Trans proline' 0 CA--C 1.548 1.185 0 C-N-CA 124.418 3.412 . . . . 0.0 111.96 179.398 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 26.8 t-80 -53.6 143.73 36.71 Favored Pre-proline 0 CA--C 1.539 0.541 0 C-N-CA 124.496 1.118 . . . . 0.0 110.759 -173.214 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -71.51 6.12 2.07 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 C-N-CA 123.907 3.071 . . . . 0.0 114.879 -177.727 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -125.23 -5.86 7.2 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.143 1.377 . . . . 0.0 112.317 177.32 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.7 tt -54.98 151.55 8.69 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 119.578 1.081 . . . . 0.0 109.931 166.159 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 12.6 mm -127.04 140.61 48.6 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.115 0 N-CA-C 105.928 -1.879 . . . . 0.0 105.928 174.331 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 78.9 m95 -81.04 159.96 67.04 Favored Pre-proline 0 CA--C 1.537 0.459 0 O-C-N 121.938 -0.476 . . . . 0.0 110.889 177.5 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.77 170.68 52.84 Favored 'Cis proline' 0 N--CA 1.455 -0.751 0 C-N-CA 124.866 -0.889 . . . . 0.0 112.621 -11.995 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -136.61 170.91 15.29 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.073 0.949 . . . . 0.0 111.544 -179.175 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 15.7 mt -142.68 103.38 4.21 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 127.611 2.364 . . . . 0.0 108.103 -171.66 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.0 tp -81.1 156.1 25.95 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 118.385 -0.817 . . . . 0.0 108.82 172.368 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -136.87 78.05 1.68 Allowed 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 120.321 1.419 . . . . 0.0 111.425 172.63 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -45.81 119.79 2.37 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 126.236 1.814 . . . . 0.0 110.972 -169.926 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.68 99.37 1.67 Allowed 'General case' 0 N--CA 1.44 -0.959 0 C-N-CA 122.958 0.503 . . . . 0.0 110.382 -164.97 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 132.79 -46.9 1.03 Allowed Glycine 0 CA--C 1.532 1.106 0 C-N-CA 127.743 2.592 . . . . 0.0 109.625 -173.17 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 74.9 m -68.33 -33.57 74.54 Favored 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 126.646 1.978 . . . . 0.0 114.319 -169.638 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.708 ' HB3' ' HB1' ' A' ' 84' ' ' ALA . 4.2 m-80 68.85 -27.04 0.15 Allowed 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 127.271 2.228 . . . . 0.0 114.422 -176.421 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -52.7 116.58 2.38 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 127.627 2.371 . . . . 0.0 109.569 169.838 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.669 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 4.4 mm? -73.32 136.93 44.53 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 106.908 -1.516 . . . . 0.0 106.908 168.107 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -106.73 87.07 2.58 Favored Pre-proline 0 C--O 1.239 0.529 0 C-N-CA 127.319 2.247 . . . . 0.0 108.652 -176.782 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -61.82 147.37 95.39 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 122.21 1.94 . . . . 0.0 109.74 176.063 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.2 mt -138.59 116.71 11.77 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 105.542 -2.021 . . . . 0.0 105.542 178.305 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 25.4 mtt-85 -82.16 -39.55 23.07 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 120.615 1.552 . . . . 0.0 114.305 -175.143 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.7 t -145.91 -177.04 5.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 120.367 1.439 . . . . 0.0 108.802 167.2 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.96 -25.77 58.49 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.39 1.876 . . . . 0.0 112.576 -178.879 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -68.24 -29.62 68.48 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.08 0.952 . . . . 0.0 111.212 173.902 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -70.28 -33.39 71.52 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 121.252 -0.905 . . . . 0.0 110.407 -176.832 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 46.1 t-105 -60.86 -32.97 72.38 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.754 -0.592 . . . . 0.0 111.35 170.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 -66.75 -42.77 85.63 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 118.474 0.579 . . . . 0.0 111.162 173.9 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? . . . . . 0 N--CA 1.47 0.537 0 CA-C-N 119.047 0.84 . . . . 0.0 110.243 179.817 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 90.3 mt . . . . . 0 C--O 1.24 0.575 0 N-CA-C 102.117 -3.29 . . . . 0.0 102.117 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -118.24 160.85 20.89 Favored 'General case' 0 C--O 1.234 0.284 0 O-C-N 123.858 0.724 . . . . 0.0 110.038 -170.633 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -66.04 124.01 21.42 Favored 'General case' 0 CA--C 1.514 -0.429 0 C-N-CA 120.161 -0.616 . . . . 0.0 109.362 -164.689 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 103.6 0.82 46.5 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-O 117.747 -1.585 . . . . 0.0 113.821 -176.877 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -55.8 -29.37 59.61 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.808 1.643 . . . . 0.0 113.797 -167.652 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.419 ' HA ' ' O ' ' A' ' 59' ' ' PHE . 17.5 ttmt 54.97 155.08 0.01 OUTLIER 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 128.672 2.789 . . . . 0.0 114.889 -179.803 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.1 mt -141.87 140.82 32.99 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.089 174.722 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 99.0 t -134.05 120.87 36.74 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 125.322 1.449 . . . . 0.0 108.479 177.367 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 26.5 p30 -99.78 173.41 6.71 Favored 'General case' 0 C--N 1.329 -0.296 1 C-N-CA 132.018 4.127 . . . . 0.0 111.181 178.745 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.25 2.69 0.05 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.837 1.655 . . . . 0.0 114.65 174.763 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -123.44 5.14 9.02 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.921 1.688 . . . . 0.0 110.581 -174.342 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.45 ' CE2' ' HA ' ' A' ' 75' ' ' PRO . 11.7 m-85 61.82 14.88 6.59 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.188 1.795 . . . . 0.0 112.877 172.928 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 8.9 m170 -66.01 109.05 2.41 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 124.708 1.203 . . . . 0.0 109.713 163.235 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 97.4 m -72.15 140.15 48.66 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 118.168 -1.413 . . . . 0.0 108.43 166.783 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.419 ' O ' ' HA ' ' A' ' 50' ' ' LYS . 55.1 m-85 -124.94 159.89 30.14 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-O 117.749 -1.12 . . . . 0.0 108.76 165.663 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.449 HG12 ' HB2' ' A' ' 70' ' ' ALA . 1.6 p -150.28 153.29 10.61 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.419 0 CA-C-N 120.522 1.51 . . . . 0.0 112.402 171.674 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 17.5 tp -77.87 131.9 37.72 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 126.071 1.748 . . . . 0.0 108.727 -177.697 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -105.75 174.61 5.81 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 123.74 0.816 . . . . 0.0 110.479 179.092 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -68.89 -2.42 9.62 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.272 -0.893 . . . . 0.0 112.927 172.559 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -85.87 0.78 52.17 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 120.369 -1.457 . . . . 0.0 112.153 165.006 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 51.87 8.94 0.07 Allowed 'General case' 0 C--O 1.237 0.426 0 C-N-CA 128.104 2.562 . . . . 0.0 113.953 -164.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -77.72 174.16 11.27 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 167.55 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 74.7 m95 -114.49 136.94 52.46 Favored 'General case' 0 N--CA 1.44 -0.944 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 -179.596 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -118.31 144.71 35.59 Favored Pre-proline 0 N--CA 1.45 -0.472 0 C-N-CA 126.013 1.725 . . . . 0.0 110.401 -170.305 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -79.28 101.97 1.47 Allowed 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 124.697 3.598 . . . . 0.0 110.073 -178.776 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.449 ' HB2' HG12 ' A' ' 60' ' ' VAL . . . -83.35 24.68 0.8 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.212 1.405 . . . . 0.0 112.625 179.432 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 67.8 165.11 0.13 Allowed Pre-proline 0 CA--C 1.543 0.679 0 C-N-CA 128.836 2.854 . . . . 0.0 111.99 -178.09 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -70.54 175.38 8.82 Favored 'Trans proline' 0 N--CA 1.452 -0.956 0 C-N-CA 121.263 1.309 . . . . 0.0 111.947 175.062 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 13.4 tp -126.6 155.36 74.9 Favored Pre-proline 0 CA--C 1.539 0.549 0 C-N-CA 126.813 2.045 . . . . 0.0 108.772 -172.95 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -73.14 165.67 32.07 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 121.793 1.662 . . . . 0.0 110.113 164.126 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.45 ' HA ' ' CE2' ' A' ' 56' ' ' PHE . 18.5 Cg_endo -59.32 -36.41 94.63 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.544 2.163 . . . . 0.0 112.459 177.767 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -78.97 -25.29 43.47 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 122.455 0.302 . . . . 0.0 110.245 -174.409 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.13 -24.58 67.28 Favored Glycine 0 CA--C 1.53 1.029 0 CA-C-O 119.137 -0.813 . . . . 0.0 113.189 -174.798 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 23.4 tp -55.09 -46.16 75.48 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 124.832 1.253 . . . . 0.0 109.962 168.737 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -75.39 -15.26 60.47 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 123.603 0.761 . . . . 0.0 110.632 -168.583 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -68.36 -44.84 74.34 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.063 -1.023 . . . . 0.0 110.981 164.215 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.8 mp -58.15 -56.93 15.75 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 175.506 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 6.0 mm -53.19 -34.19 21.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 C-N-CA 125.059 1.344 . . . . 0.0 110.986 -178.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 12.2 ttt-85 -48.02 -38.89 18.22 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 119.381 0.992 . . . . 0.0 112.559 175.499 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.708 ' HB1' ' HB3' ' A' ' 23' ' ' ASN . . . -71.37 -42.96 67.77 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.373 0.988 . . . . 0.0 111.773 -179.074 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.669 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 13.5 t60 -55.24 -55.05 35.72 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.778 0.799 . . . . 0.0 109.281 170.719 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 95.1 m -68.29 -29.04 67.73 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 121.324 -0.86 . . . . 0.0 111.333 -172.13 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -78.95 -24.26 44.04 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 117.373 -1.299 . . . . 0.0 112.602 178.89 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.4 t -92.6 -17.75 23.97 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.914 0.779 . . . . 0.0 110.821 -177.136 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 70.1 mt -107.28 -22.35 12.63 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.581 0.752 . . . . 0.0 111.877 178.134 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 79.96 53.83 4.09 Favored Glycine 0 C--N 1.337 0.614 0 N-CA-C 110.913 -0.875 . . . . 0.0 110.913 -177.24 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' HIS . . . . . 0.421 ' CD2' HD13 ' A' ' 112' ' ' LEU . 35.3 m-70 . . . . . 0 C--O 1.232 0.157 0 C-N-CA 122.969 0.508 . . . . 0.0 110.673 177.052 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 7.9 m80 . . . . . 0 N--CA 1.464 0.271 0 CA-C-O 119.067 -0.492 . . . . 0.0 111.831 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.597 HD13 ' HB2' ' A' ' 105' ' ' ALA . 84.5 mt -150.69 154.39 37.32 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 124.519 1.128 . . . . 0.0 109.655 -159.738 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 16.0 t-160 -83.85 -40.01 19.2 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 124.571 1.169 . . . . 0.0 111.397 173.055 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 88.8 p -172.26 -175.36 1.4 Allowed 'General case' 0 C--O 1.236 0.351 0 C-N-CA 124.241 1.017 . . . . 0.0 110.414 -171.962 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 67.5 t -55.0 -45.27 76.67 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.291 0 C-N-CA 125.106 1.362 . . . . 0.0 110.329 177.641 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 2.8 ttm -62.29 -45.63 92.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 118.527 0.603 . . . . 0.0 110.113 -171.769 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.55 -39.8 85.18 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 124.559 1.144 . . . . 0.0 110.08 173.167 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.597 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -61.62 -53.82 51.07 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 123.691 0.796 . . . . 0.0 111.566 178.363 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 32.4 mm -53.86 -47.08 64.19 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 -178.391 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -60.12 -51.54 69.16 Favored 'General case' 0 CA--C 1.521 -0.153 0 C-N-CA 123.71 0.804 . . . . 0.0 111.163 -179.813 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.401 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 13.0 t80 -53.27 -65.13 0.62 Allowed 'General case' 0 C--O 1.221 -0.42 0 C-N-CA 126.371 1.868 . . . . 0.0 110.176 178.606 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 9.2 mp -52.29 -45.12 65.36 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 125.784 1.634 . . . . 0.0 112.015 -178.887 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -65.35 -33.98 77.23 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 118.668 0.667 . . . . 0.0 111.548 177.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -80.57 -18.74 47.4 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.741 0.816 . . . . 0.0 112.836 177.631 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.421 HD13 ' CD2' ' A' ' 91' ' ' HIS . 63.6 mt . . . . . 0 CA--C 1.518 -0.251 0 C-N-CA 124.317 1.047 . . . . 0.0 110.98 173.643 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.238 0.489 0 N-CA-C 111.662 0.245 . . . . 0.0 111.662 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -71.91 70.23 2.91 Favored 'Trans proline' 0 N--CA 1.45 -1.062 0 C-N-CA 123.076 2.517 . . . . 0.0 110.089 169.57 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 75.55 148.09 0.12 Allowed Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 129.098 2.959 . . . . 0.0 113.432 -176.812 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -78.1 -28.74 4.61 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 122.688 2.259 . . . . 0.0 113.25 173.922 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -69.93 -22.34 63.2 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.701 1.137 . . . . 0.0 112.293 176.322 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 tt -63.77 135.56 56.74 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 166.368 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 3.0 tt -107.85 178.92 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.165 0 C-N-CA 124.286 1.035 . . . . 0.0 108.443 176.029 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 58.2 m95 -122.87 149.87 57.49 Favored Pre-proline 0 C--O 1.237 0.4 0 O-C-N 121.586 -0.696 . . . . 0.0 109.568 172.959 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -68.69 162.59 80.6 Favored 'Cis proline' 0 CA--C 1.542 0.917 0 N-CA-C 114.713 1.005 . . . . 0.0 114.713 -1.622 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.585 ' HA ' HD22 ' A' ' 16' ' ' LEU . . . -139.8 169.79 17.08 Favored 'General case' 0 CA--C 1.519 -0.219 0 C-N-CA 127.088 2.155 . . . . 0.0 110.967 -177.503 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.683 HD21 HG13 ' A' ' 102' ' ' VAL . 2.8 mm? -138.79 112.93 8.64 Favored 'General case' 0 N--CA 1.436 -1.164 0 C-N-CA 126.895 2.078 . . . . 0.0 108.597 -156.192 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 22.2 tp -99.72 151.51 21.15 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 123.772 0.67 . . . . 0.0 109.469 169.138 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.48 88.54 2.15 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 171.648 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -52.94 138.0 31.17 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 118.195 0.452 . . . . 0.0 110.381 -171.649 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -59.02 109.92 0.93 Allowed 'General case' 0 N--CA 1.433 -1.321 0 C-N-CA 124.69 1.196 . . . . 0.0 108.364 178.987 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 110.09 -36.17 4.43 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 126.201 1.858 . . . . 0.0 112.825 -179.231 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 1.8 p -69.45 171.27 9.0 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 119.661 1.731 . . . . 0.0 109.151 177.083 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 11.5 m-80 -116.8 -16.49 10.62 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.622 -1.172 . . . . 0.0 108.883 172.584 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -76.83 109.59 10.75 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 124.359 1.064 . . . . 0.0 108.851 -170.286 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.466 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 4.1 mm? -68.74 137.22 53.88 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 108.164 -1.051 . . . . 0.0 108.164 172.648 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.405 HD22 ' HA ' ' A' ' 26' ' ' LEU . 0.2 OUTLIER -107.05 88.41 3.7 Favored Pre-proline 0 C--N 1.327 -0.391 0 C-N-CA 128.844 2.858 . . . . 0.0 112.786 -170.956 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -66.39 120.79 7.96 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 122.194 1.929 . . . . 0.0 111.28 174.868 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -111.99 107.78 16.87 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 126.805 2.042 . . . . 0.0 106.074 168.102 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 4.4 mtt-85 -59.73 -49.55 77.29 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.093 0.557 . . . . 0.0 110.206 178.151 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 22.3 p -140.4 174.68 10.28 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 123.348 0.659 . . . . 0.0 109.642 178.776 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -56.55 -36.41 69.24 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 124.543 1.137 . . . . 0.0 111.479 178.391 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.5 -30.93 71.97 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-N 118.959 0.8 . . . . 0.0 110.177 -177.617 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -69.1 -40.6 78.3 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-N 119.43 1.014 . . . . 0.0 111.197 174.086 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 13.0 t-105 -56.7 -43.32 80.4 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.254 0.622 . . . . 0.0 110.514 175.128 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -62.6 -55.95 22.36 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 174.896 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.466 0.337 0 C-N-CA 124.085 0.954 . . . . 0.0 112.726 -173.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 56.6 mt . . . . . 0 N--CA 1.456 -0.144 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -118.53 140.96 49.05 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 125.223 1.409 . . . . 0.0 108.363 -179.14 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.563 ' HA ' HD13 ' A' ' 61' ' ' LEU . 43.1 m-85 -63.79 108.99 1.58 Allowed 'General case' 0 C--O 1.234 0.259 0 N-CA-C 107.051 -1.463 . . . . 0.0 107.051 170.741 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 131.8 -12.58 5.36 Favored Glycine 0 CA--C 1.527 0.791 0 CA-C-O 118.919 -0.934 . . . . 0.0 112.866 -178.335 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -60.22 -10.76 4.93 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 127.134 2.173 . . . . 0.0 115.914 -166.349 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.6 ttmt 54.18 124.31 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 129.763 3.225 . . . . 0.0 114.786 175.933 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 51' ' ' LEU . 1.3 mm? -99.62 149.94 22.76 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 161.217 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 24.1 t -128.98 152.3 36.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 C-N-CA 128.327 2.651 . . . . 0.0 105.189 164.718 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -133.5 179.41 6.23 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.216 1.406 . . . . 0.0 110.86 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.4 m -70.28 -10.69 59.68 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 178.459 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 62.8 m-80 -85.94 -3.46 58.93 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 124.347 1.059 . . . . 0.0 111.356 170.486 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 60.55 23.25 12.96 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.226 1.01 . . . . 0.0 110.157 -170.22 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 49.2 m170 -75.34 114.42 13.86 Favored 'General case' 0 C--O 1.232 0.176 0 O-C-N 120.655 -1.278 . . . . 0.0 109.035 167.043 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 23.2 m -78.43 153.17 31.72 Favored 'General case' 0 C--O 1.239 0.5 0 N-CA-C 108.334 -0.988 . . . . 0.0 108.334 169.15 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -139.45 152.26 46.88 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.759 1.624 . . . . 0.0 107.861 171.988 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 63.0 t -136.29 144.25 33.52 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 127.848 2.459 . . . . 0.0 106.927 175.133 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.563 HD13 ' HA ' ' A' ' 47' ' ' TYR . 0.5 OUTLIER -81.02 134.41 35.67 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 127.331 2.252 . . . . 0.0 110.034 -178.493 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -109.97 168.48 9.4 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.729 1.15 . . . . 0.0 111.594 174.584 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -61.3 -15.09 31.92 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 120.384 -1.447 . . . . 0.0 112.876 178.733 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.05 -2.0 22.47 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 126.591 1.957 . . . . 0.0 112.63 171.66 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 74.4 -12.16 0.93 Allowed 'General case' 0 C--N 1.346 0.427 0 C-N-CA 127.009 2.124 . . . . 0.0 111.653 -175.058 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -75.21 156.86 35.35 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 119.348 0.976 . . . . 0.0 112.054 177.753 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 65.9 m95 -104.08 96.19 6.49 Favored 'General case' 0 N--CA 1.436 -1.139 0 N-CA-C 105.211 -2.144 . . . . 0.0 105.211 174.529 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -81.54 161.26 62.34 Favored Pre-proline 0 C--O 1.239 0.543 0 C-N-CA 124.06 0.944 . . . . 0.0 109.847 177.914 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -74.34 148.95 39.28 Favored 'Trans proline' 0 N--CA 1.449 -1.095 0 C-N-CA 122.722 2.281 . . . . 0.0 109.136 -175.29 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -138.89 37.03 2.16 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.172 0.989 . . . . 0.0 110.757 -171.211 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 65.32 164.42 0.12 Allowed Pre-proline 0 CA--C 1.541 0.618 0 C-N-CA 129.001 2.92 . . . . 0.0 113.096 -174.821 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -69.97 -178.6 2.5 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 121.758 1.638 . . . . 0.0 111.699 169.245 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.9 tt -128.38 143.72 49.24 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 125.775 1.63 . . . . 0.0 108.858 -172.647 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -82.87 164.96 15.59 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.679 2.919 . . . . 0.0 111.155 -176.649 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -60.07 -28.32 86.78 Favored 'Trans proline' 0 CA--C 1.535 0.565 0 C-N-CA 121.612 1.542 . . . . 0.0 113.15 -178.13 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -84.24 -20.52 32.1 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.66 0.784 . . . . 0.0 112.731 175.679 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.65 -26.66 70.02 Favored Glycine 0 C--N 1.341 0.82 0 CA-C-N 119.154 0.888 . . . . 0.0 111.371 -173.347 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 18.5 tp -61.23 -52.3 65.35 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 126.391 1.876 . . . . 0.0 108.418 175.041 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -62.93 -34.95 78.54 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 123.128 0.571 . . . . 0.0 109.969 179.313 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.65 -32.44 73.76 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 127.055 2.142 . . . . 0.0 112.566 178.924 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.5 mp -67.07 -66.69 0.53 Allowed 'General case' 0 C--O 1.233 0.208 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 165.332 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 12.7 mm -53.65 -29.46 17.42 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 C-N-CA 125.941 1.697 . . . . 0.0 112.048 -171.103 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.7 mtp180 -44.82 -46.7 10.83 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 126.312 1.845 . . . . 0.0 110.979 173.912 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.74 -47.09 85.07 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.947 0.794 . . . . 0.0 111.637 179.498 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.466 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 7.0 t60 -59.45 -49.36 78.1 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.872 0.869 . . . . 0.0 109.822 179.547 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 84.8 m -69.17 -26.53 64.9 Favored 'General case' 0 C--N 1.329 -0.287 0 O-C-N 120.972 -1.08 . . . . 0.0 111.307 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -78.41 -14.74 59.25 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.469 1.108 . . . . 0.0 113.427 177.137 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.5 t -98.37 -16.86 19.14 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.968 0.804 . . . . 0.0 111.488 178.632 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 86.8 mt -109.41 -41.49 4.6 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.468 1.107 . . . . 0.0 110.84 178.432 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 103.83 64.8 0.69 Allowed Glycine 0 C--N 1.334 0.426 0 C-N-CA 125.093 1.33 . . . . 0.0 111.428 -178.624 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 10.1 m-70 . . . . . 0 C--O 1.233 0.231 0 CA-C-O 122.373 1.082 . . . . 0.0 111.46 177.491 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 5.7 m80 . . . . . 0 CA--C 1.54 0.559 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 95.3 mt -133.59 104.91 6.59 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.427 1.491 . . . . 0.0 109.186 -164.541 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -45.53 -40.7 8.9 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 127.877 2.471 . . . . 0.0 114.691 178.367 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 34.6 t -161.16 165.94 28.68 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 -168.777 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.683 HG13 HD21 ' A' ' 16' ' ' LEU . 45.5 t -61.64 -42.88 95.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 175.513 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 4.5 ttm -56.51 -44.89 81.17 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 123.752 0.821 . . . . 0.0 111.58 177.791 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.54 -38.42 87.1 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 110.395 -0.224 . . . . 0.0 110.395 177.865 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.98 -36.32 74.67 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 118.302 -0.856 . . . . 0.0 112.269 175.38 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.4 mm -57.46 -57.72 9.01 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.13 0 CA-C-N 119.389 0.995 . . . . 0.0 108.629 177.228 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.65 -20.97 52.88 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 118.64 0.655 . . . . 0.0 112.677 -169.416 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -55.94 -61.64 2.24 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 164.001 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 73.1 mt -63.57 -37.44 87.33 Favored 'General case' 0 C--O 1.232 0.141 0 C-N-CA 122.725 0.41 . . . . 0.0 110.699 -175.877 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -64.34 -17.6 63.86 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -176.622 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -100.38 -5.66 26.91 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.735 1.214 . . . . 0.0 113.462 -179.044 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 62.7 mt . . . . . 0 CA--C 1.534 0.329 0 CA-C-N 118.58 0.627 . . . . 0.0 110.479 173.43 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.536 0.425 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -64.59 -31.88 59.34 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 121.76 1.64 . . . . 0.0 111.512 -177.766 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -160.58 156.42 22.27 Favored Pre-proline 0 CA--C 1.538 0.503 0 CA-C-O 117.537 -1.22 . . . . 0.0 108.916 178.269 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -83.71 -25.14 2.56 Favored 'Trans proline' 0 CA--C 1.536 0.59 0 C-N-CA 122.566 2.178 . . . . 0.0 112.959 171.974 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -64.84 -18.71 65.37 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.55 1.068 . . . . 0.0 111.703 170.445 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 tt -77.81 123.24 26.48 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.161 0.984 . . . . 0.0 109.18 175.644 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.1 mm -123.59 108.57 21.2 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 N-CA-C 106.625 -1.62 . . . . 0.0 106.625 -179.451 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 82.6 m95 -53.83 155.49 5.94 Favored Pre-proline 0 C--O 1.237 0.431 0 C-N-CA 124.983 1.313 . . . . 0.0 113.427 -177.158 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -68.42 169.37 57.24 Favored 'Cis proline' 0 CA--C 1.534 0.493 0 N-CA-C 113.965 0.717 . . . . 0.0 113.965 -2.348 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -137.21 168.39 19.71 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 123.846 0.858 . . . . 0.0 110.79 177.216 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 14.3 mt -136.73 108.91 7.24 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 126.805 2.042 . . . . 0.0 107.242 -175.544 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.7 tp -81.01 144.36 31.84 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.633 -0.876 . . . . 0.0 108.633 174.232 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.15 94.06 2.41 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-N 118.571 0.623 . . . . 0.0 109.77 168.907 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -57.09 149.89 18.41 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 121.246 0.546 . . . . 0.0 110.328 -179.63 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -64.08 -10.04 19.94 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 171.154 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -109.06 0.5 31.52 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 125.831 1.681 . . . . 0.0 114.299 -175.91 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -142.82 178.41 7.67 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 120.176 1.988 . . . . 0.0 110.944 177.836 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.437 ' HB3' ' HB1' ' A' ' 84' ' ' ALA . 13.4 m-80 -121.66 -14.07 8.22 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 124.761 1.225 . . . . 0.0 109.163 176.39 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -65.71 117.16 7.74 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 107.467 -1.308 . . . . 0.0 107.467 175.567 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.546 ' HG ' HD13 ' A' ' 82' ' ' ILE . 3.6 mm? -74.41 136.83 42.39 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 106.897 -1.52 . . . . 0.0 106.897 168.946 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -110.34 87.03 5.8 Favored Pre-proline 0 C--O 1.237 0.399 0 C-N-CA 125.704 1.602 . . . . 0.0 108.491 -173.131 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -65.31 136.65 48.14 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 123.454 2.769 . . . . 0.0 110.049 -178.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.5 mt -132.93 98.26 4.25 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 -178.496 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.9 mmt85 -50.96 -44.11 60.51 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.487 1.515 . . . . 0.0 111.317 -177.095 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 14.4 t -160.9 -177.59 6.24 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 121.444 0.64 . . . . 0.0 109.385 -177.921 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -50.38 -38.83 44.66 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 125.537 1.535 . . . . 0.0 110.886 175.644 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -62.35 -33.02 73.9 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.941 0.897 . . . . 0.0 112.243 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.12 -40.15 75.04 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 121.393 -0.817 . . . . 0.0 109.607 174.509 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 47.6 t-105 -63.39 -34.03 76.84 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.214 0.606 . . . . 0.0 111.303 175.57 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -59.63 -62.24 2.03 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 169.544 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 13.2 mtt85 . . . . . 0 C--O 1.226 -0.163 0 C-N-CA 124.138 0.975 . . . . 0.0 113.548 -174.841 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.4 mt . . . . . 0 C--O 1.237 0.405 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 -143.54 151.57 40.39 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 124.259 1.024 . . . . 0.0 111.276 -167.258 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -63.81 115.94 5.29 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 168.518 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 118.93 -0.17 14.95 Favored Glycine 0 CA--C 1.527 0.835 0 CA-C-O 118.71 -1.05 . . . . 0.0 113.136 -173.027 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -65.32 -20.62 66.49 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 115.627 1.714 . . . . 0.0 115.627 -164.978 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 10.5 ttmt 44.49 137.08 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 131.385 3.874 . . . . 0.0 117.26 178.722 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 14.3 mt -125.65 161.94 26.12 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 114.804 -1.089 . . . . 0.0 109.392 167.503 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 95.2 t -132.38 151.78 35.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 105.533 -2.025 . . . . 0.0 105.533 158.319 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -125.51 -179.47 4.64 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 126.201 1.8 . . . . 0.0 110.828 179.079 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.3 m -64.69 -17.2 63.88 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 178.757 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 31.9 m120 -77.03 -10.71 59.55 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 117.995 -1.002 . . . . 0.0 111.964 171.053 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 64.76 21.55 12.4 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 125.657 1.583 . . . . 0.0 111.658 -167.437 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 52.3 m170 -74.53 110.32 8.73 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 106.435 -1.691 . . . . 0.0 106.435 167.495 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 58.6 m -71.79 151.81 43.2 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 165.851 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 46.1 m-85 -143.33 160.67 40.1 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 126.461 1.905 . . . . 0.0 108.076 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 2.2 p -154.92 152.34 9.43 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.341 0 CA-C-N 120.741 1.609 . . . . 0.0 111.372 169.481 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 17.1 tp -77.98 144.01 37.11 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 125.396 1.478 . . . . 0.0 108.215 -179.32 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -120.67 168.19 11.66 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 125.559 1.544 . . . . 0.0 110.062 -172.397 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -59.64 -31.15 69.25 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 125.321 1.449 . . . . 0.0 110.841 178.448 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.2 2.87 11.95 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 123.619 0.767 . . . . 0.0 112.473 175.028 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 55.51 18.77 2.84 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 128.937 2.895 . . . . 0.0 113.755 176.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -84.82 -177.16 6.51 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 124.659 1.184 . . . . 0.0 108.549 154.764 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 50.6 m95 -112.31 154.54 25.54 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 171.026 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -124.7 150.85 66.68 Favored Pre-proline 0 C--O 1.236 0.374 0 C-N-CA 124.925 1.29 . . . . 0.0 110.221 175.686 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -71.24 111.79 3.17 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 123.75 2.967 . . . . 0.0 109.99 176.802 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.46 34.87 0.33 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.685 1.194 . . . . 0.0 110.807 171.326 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.83 166.64 0.12 Allowed Pre-proline 0 CA--C 1.545 0.785 0 C-N-CA 125.927 1.691 . . . . 0.0 112.131 -179.695 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -70.57 176.22 7.69 Favored 'Trans proline' 0 CA--C 1.535 0.571 0 C-N-CA 121.219 1.279 . . . . 0.0 111.076 166.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 20.6 tp -131.43 144.58 54.01 Favored Pre-proline 0 CA--C 1.536 0.441 0 C-N-CA 125.616 1.566 . . . . 0.0 109.324 -174.053 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -77.14 168.19 23.64 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 122.416 2.078 . . . . 0.0 109.555 176.679 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -59.05 -47.08 19.05 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 122.275 1.983 . . . . 0.0 112.367 178.756 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -79.16 -6.08 55.71 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 119.482 1.037 . . . . 0.0 110.108 -177.224 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.6 -24.45 67.92 Favored Glycine 0 CA--C 1.534 1.243 0 CA-C-O 118.841 -0.977 . . . . 0.0 112.972 164.021 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 25.6 tp -59.2 -48.08 82.94 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.588 1.694 . . . . 0.0 108.916 178.636 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -67.51 -7.5 26.3 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 125.421 1.488 . . . . 0.0 112.34 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -82.69 -34.94 27.2 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 121.148 1.795 . . . . 0.0 111.251 168.794 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -66.96 -70.76 0.23 Allowed 'General case' 0 N--CA 1.457 -0.114 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 178.19 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.546 HD13 ' HG ' ' A' ' 25' ' ' LEU . 34.0 mm -57.53 -21.03 15.02 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 C-N-CA 123.102 0.561 . . . . 0.0 112.219 -174.95 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.87 -47.84 11.13 Favored 'General case' 0 C--N 1.343 0.286 0 C-N-CA 124.3 1.04 . . . . 0.0 111.716 172.159 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.437 ' HB1' ' HB3' ' A' ' 23' ' ' ASN . . . -65.79 -48.85 70.38 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.23 0.612 . . . . 0.0 109.952 -171.66 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.526 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 10.5 t60 -55.31 -49.32 72.46 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 126.036 1.734 . . . . 0.0 110.01 175.713 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 90.0 m -61.64 -46.41 89.89 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.463 179.063 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.55 -40.4 94.56 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 118.877 0.762 . . . . 0.0 112.33 -178.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.4 t -78.59 7.0 7.46 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.025 0.53 . . . . 0.0 111.753 178.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.5 mt -126.83 -21.99 3.94 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.005 -1.059 . . . . 0.0 111.35 173.01 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 97.9 6.8 56.91 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 126.378 1.942 . . . . 0.0 113.997 -176.714 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 81.3 m-70 . . . . . 0 C--O 1.237 0.437 0 CA-C-N 119.404 1.602 . . . . 0.0 110.71 -174.093 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.535 0.402 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 95.0 mt -145.39 171.44 14.61 Favored 'General case' 0 C--O 1.225 -0.184 0 C-N-CA 127.478 2.311 . . . . 0.0 108.503 -166.655 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 27.2 t-80 -131.06 -29.56 1.84 Allowed 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 125.066 1.346 . . . . 0.0 110.135 -172.966 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 5.1 m -173.45 170.53 4.15 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.731 1.612 . . . . 0.0 108.681 -175.771 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 70.5 t -59.62 -44.0 92.39 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 172.149 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 3.4 tpt -47.34 -54.35 11.32 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.12 0.968 . . . . 0.0 109.377 174.9 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.63 -29.56 70.78 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.536 0.734 . . . . 0.0 112.184 -175.572 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -69.61 -48.67 59.29 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.553 1.141 . . . . 0.0 110.417 175.219 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 11.5 mm -59.74 -32.66 50.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 123.99 0.916 . . . . 0.0 109.723 178.665 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -69.0 -50.15 51.44 Favored 'General case' 0 C--N 1.338 0.091 0 C-N-CA 123.501 0.72 . . . . 0.0 110.437 175.57 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -54.84 -60.81 2.86 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 125.92 1.688 . . . . 0.0 111.105 178.259 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.8 mp -52.24 -40.92 62.29 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.412 1.085 . . . . 0.0 112.627 -179.242 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 20.5 m-80 -72.45 -28.54 63.0 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 118.881 0.764 . . . . 0.0 112.718 176.202 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -76.95 -27.53 54.85 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 121.353 -0.842 . . . . 0.0 111.296 177.028 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 40.5 mt . . . . . 0 CA--C 1.522 -0.107 0 C-N-CA 123.656 0.782 . . . . 0.0 109.401 179.729 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.24 0.577 0 CA-C-O 118.453 -0.784 . . . . 0.0 109.863 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -65.59 -47.42 4.11 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 122.262 1.975 . . . . 0.0 111.881 -177.704 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -146.58 145.94 25.15 Favored Pre-proline 0 C--O 1.234 0.281 0 N-CA-C 106.745 -1.576 . . . . 0.0 106.745 170.31 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -73.96 -34.6 5.01 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.15 1.9 . . . . 0.0 111.348 175.89 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -76.29 -7.75 55.6 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.994 1.317 . . . . 0.0 113.062 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.664 HD21 ' HB2' ' A' ' 15' ' ' ALA . 5.1 tt -60.05 107.73 0.67 Allowed 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.236 1.015 . . . . 0.0 108.742 170.411 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 33.3 mm -83.9 100.2 7.13 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 172.23 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 64.5 m95 -56.14 155.31 12.82 Favored Pre-proline 0 CA--C 1.544 0.72 0 O-C-N 121.486 -0.759 . . . . 0.0 111.696 178.433 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -67.79 169.34 53.82 Favored 'Cis proline' 0 N--CA 1.459 -0.544 0 C-N-CA 125.425 -0.656 . . . . 0.0 113.468 -4.377 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.664 ' HB2' HD21 ' A' ' 11' ' ' LEU . . . -135.64 170.24 16.28 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.515 0.726 . . . . 0.0 111.059 176.293 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 mt -136.96 106.9 6.27 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 126.951 2.1 . . . . 0.0 106.203 178.618 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.3 tp -70.26 146.87 50.34 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 105.597 -2.001 . . . . 0.0 105.597 161.645 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.27 88.48 2.02 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 173.861 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -61.41 158.11 15.38 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 123.1 1.428 . . . . 0.0 112.417 -158.732 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.27 134.93 40.98 Favored 'General case' 0 N--CA 1.431 -1.416 0 N-CA-C 105.598 -2.001 . . . . 0.0 105.598 178.908 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 88.69 -54.79 4.11 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 125.162 1.363 . . . . 0.0 111.137 -175.046 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -80.09 -13.65 59.12 Favored 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 115.327 1.603 . . . . 0.0 115.327 -159.521 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.507 ' HB3' ' HB1' ' A' ' 84' ' ' ALA . 6.5 m-80 64.47 -20.18 0.07 Allowed 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 121.664 2.029 . . . . 0.0 114.298 175.33 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -73.48 154.81 39.76 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 127.665 2.386 . . . . 0.0 109.525 178.757 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.9 mt -104.17 155.23 18.89 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 125.262 1.425 . . . . 0.0 109.147 -178.382 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -124.5 86.36 55.31 Favored Pre-proline 0 CA--C 1.538 0.506 0 C-N-CA 124.997 1.319 . . . . 0.0 108.975 177.014 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -68.68 114.82 3.65 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 124.509 3.473 . . . . 0.0 111.512 -177.667 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.8 mt -116.62 104.9 11.85 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 124.997 1.319 . . . . 0.0 108.447 -173.143 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -58.57 -44.7 89.85 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.22 0.533 . . . . 0.0 111.737 -177.288 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.3 p -151.44 174.47 13.33 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 124.878 1.271 . . . . 0.0 108.937 -162.301 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -69.38 -27.76 65.6 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 119.921 -0.712 . . . . 0.0 111.604 174.764 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -56.55 -32.8 65.49 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.298 0.954 . . . . 0.0 110.131 169.048 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -68.27 -42.98 78.79 Favored 'General case' 0 C--O 1.223 -0.302 0 O-C-N 120.988 -1.07 . . . . 0.0 110.05 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 31.3 t-105 -59.53 -32.19 70.08 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.514 -0.741 . . . . 0.0 112.02 174.699 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -65.12 -56.44 12.94 Favored 'General case' 0 CA--C 1.52 -0.178 0 O-C-N 121.067 -1.021 . . . . 0.0 109.057 175.202 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 87.3 mtm180 . . . . . 0 C--O 1.221 -0.414 0 C-N-CA 124.073 0.949 . . . . 0.0 110.259 -179.415 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 67.5 mt . . . . . 0 CA--C 1.518 -0.263 0 N-CA-C 106.375 -1.713 . . . . 0.0 106.375 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 -109.52 149.11 30.1 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 172.947 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.417 ' HA ' ' HB3' ' A' ' 61' ' ' LEU . 24.2 m-85 -70.16 70.62 0.39 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 126.674 1.99 . . . . 0.0 110.016 -178.181 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 160.76 2.97 0.06 OUTLIER Glycine 0 N--CA 1.439 -1.108 0 C-N-CA 123.553 0.597 . . . . 0.0 112.003 -172.475 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -65.35 -10.2 31.07 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 -172.412 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.7 ttmt 60.05 140.75 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 129.228 3.011 . . . . 0.0 111.997 174.779 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 5.7 mt -130.73 154.77 47.61 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 106.538 -1.653 . . . . 0.0 106.538 167.318 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 53.2 t -136.79 122.33 27.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 102.687 -3.079 . . . . 0.0 102.687 173.201 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -82.03 -165.54 1.02 Allowed 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 127.965 2.506 . . . . 0.0 112.486 167.46 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 83.6 p -73.06 -29.86 63.28 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 120.254 1.388 . . . . 0.0 114.043 176.18 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -83.18 1.47 40.44 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 126.224 1.81 . . . . 0.0 111.259 -168.889 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 65.46 22.7 11.89 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.615 1.966 . . . . 0.0 111.364 -173.599 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -66.76 112.49 4.26 Favored 'General case' 0 C--O 1.232 0.152 0 O-C-N 120.381 -1.449 . . . . 0.0 109.934 161.213 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 11.4 m -69.35 158.28 35.38 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 119.956 -0.698 . . . . 0.0 109.36 161.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -141.75 166.1 25.65 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 125.518 1.527 . . . . 0.0 109.445 172.294 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 34.1 t -144.46 134.44 19.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 C-N-CA 127.141 2.176 . . . . 0.0 107.209 177.084 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.417 ' HB3' ' HA ' ' A' ' 47' ' ' TYR . 0.2 OUTLIER -78.79 135.6 37.13 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 106.605 -1.628 . . . . 0.0 106.605 167.056 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -120.02 170.61 9.12 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 119.751 1.159 . . . . 0.0 111.92 174.112 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -54.91 -17.29 3.48 Favored 'General case' 0 N--CA 1.468 0.467 0 O-C-N 121.034 -1.041 . . . . 0.0 112.865 175.288 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -72.51 -5.29 35.94 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.551 1.14 . . . . 0.0 113.592 173.697 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 68.89 6.78 5.79 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 126.683 1.993 . . . . 0.0 112.574 -176.964 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -95.12 162.47 13.7 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 119.396 0.998 . . . . 0.0 111.667 171.648 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 56.5 m95 -107.51 78.7 1.23 Allowed 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 124.979 1.312 . . . . 0.0 108.59 178.69 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 63.0 t-80 -60.7 144.09 89.92 Favored Pre-proline 0 CA--C 1.545 0.75 0 CA-C-O 119.136 -0.459 . . . . 0.0 110.187 -171.94 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.82 113.23 3.48 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 124.103 3.202 . . . . 0.0 111.097 173.729 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -94.13 40.43 1.08 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.857 1.663 . . . . 0.0 111.24 -179.107 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.91 165.25 0.13 Allowed Pre-proline 0 CA--C 1.543 0.677 0 C-N-CA 127.856 2.462 . . . . 0.0 113.485 175.806 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -68.16 171.21 12.99 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.726 2.284 . . . . 0.0 112.025 167.467 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.0 tp -146.95 146.15 24.96 Favored Pre-proline 0 CA--C 1.534 0.335 0 C-N-CA 124.121 0.968 . . . . 0.0 111.41 -170.253 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -64.75 164.47 24.1 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 123.138 2.558 . . . . 0.0 113.384 171.591 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -61.17 -28.75 85.74 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 123.806 3.004 . . . . 0.0 112.809 174.736 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -82.51 -16.99 46.69 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 121.803 -0.561 . . . . 0.0 110.941 -179.393 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.93 -32.18 80.21 Favored Glycine 0 CA--C 1.534 1.263 0 N-CA-C 110.926 -0.87 . . . . 0.0 110.926 177.031 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 23.0 tp -58.71 -52.61 64.94 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.001 -1.293 . . . . 0.0 110.059 169.697 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -52.39 -27.33 15.3 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.885 0.874 . . . . 0.0 113.04 -174.128 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -72.07 -42.13 66.58 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.01 0.924 . . . . 0.0 112.171 178.242 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.5 mp -61.8 -44.83 96.08 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 123.909 0.884 . . . . 0.0 110.696 173.591 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 49.4 mm -55.83 -50.09 70.6 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 C-N-CA 123.713 0.805 . . . . 0.0 108.949 175.429 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.97 -46.19 10.96 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 125.475 1.51 . . . . 0.0 112.448 174.934 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.507 ' HB1' ' HB3' ' A' ' 23' ' ' ASN . . . -58.49 -51.4 70.02 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 123.457 0.473 . . . . 0.0 111.049 -177.156 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 26.5 t60 -61.24 -46.27 91.09 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.469 1.108 . . . . 0.0 110.508 177.936 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 73.1 m -60.97 -46.31 91.26 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 117.54 -1.219 . . . . 0.0 110.341 -178.001 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.84 -31.11 68.8 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 119.851 1.205 . . . . 0.0 112.22 -176.35 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 15.3 t -73.25 -5.88 42.32 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 117.727 -1.13 . . . . 0.0 111.878 176.46 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 90.0 mt -123.51 -62.33 1.32 Allowed 'General case' 0 C--N 1.342 0.267 0 CA-C-N 120.039 1.29 . . . . 0.0 110.405 -176.687 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 153.61 7.22 0.09 OUTLIER Glycine 0 CA--C 1.537 1.439 0 C-N-CA 126.907 2.194 . . . . 0.0 113.224 176.669 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 15.5 m170 . . . . . 0 N--CA 1.468 0.439 0 CA-C-N 118.645 1.222 . . . . 0.0 109.468 -160.769 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 3.5 m80 . . . . . 0 CA--C 1.542 0.64 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.491 HD13 ' HB2' ' A' ' 105' ' ' ALA . 81.4 mt -137.28 158.76 43.71 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 125.895 1.678 . . . . 0.0 110.277 -160.815 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -120.22 -20.97 7.14 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 124.062 0.945 . . . . 0.0 110.744 -163.036 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 17.2 m -160.1 173.92 15.08 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 127.177 2.191 . . . . 0.0 108.2 170.714 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 41.0 t -61.11 -40.58 86.23 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.307 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 168.716 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 4.1 ttm -60.79 -41.67 96.04 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 118.513 0.597 . . . . 0.0 110.794 -178.683 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -58.22 -35.03 71.07 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-O 119.187 -0.435 . . . . 0.0 110.869 174.556 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.491 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -65.18 -39.97 93.61 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 118.721 0.691 . . . . 0.0 111.545 179.332 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.7 mm -59.92 -51.62 70.74 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 177.193 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -62.89 -49.26 75.52 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.366 1.066 . . . . 0.0 109.795 -176.414 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -55.26 -52.57 62.97 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 126.621 1.968 . . . . 0.0 111.784 179.465 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 41.2 mt -62.22 -37.78 86.66 Favored 'General case' 0 CA--C 1.523 -0.088 0 CA-C-N 117.679 0.218 . . . . 0.0 110.8 -172.284 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -78.38 -26.36 46.53 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 122.569 0.348 . . . . 0.0 111.38 177.026 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -74.64 -25.83 59.47 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 118.628 -0.701 . . . . 0.0 112.413 174.64 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 13.1 mt . . . . . 0 C--O 1.233 0.23 0 CA-C-N 118.931 0.787 . . . . 0.0 110.304 177.022 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.467 0.406 0 CA-C-O 121.169 0.509 . . . . 0.0 110.994 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -163.04 148.41 15.08 Favored Glycine 0 CA--C 1.52 0.349 0 N-CA-C 109.115 -1.594 . . . . 0.0 109.115 175.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -112.99 16.38 19.38 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 118.187 0.994 . . . . 0.0 113.487 -159.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -164.17 171.99 39.86 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 108.929 -1.668 . . . . 0.0 108.929 168.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -83.72 15.19 3.35 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.881 0.872 . . . . 0.0 110.992 -173.499 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 44.1 p -66.76 158.64 79.1 Favored Pre-proline 0 CA--C 1.537 0.449 0 C-N-CA 125.78 1.632 . . . . 0.0 111.574 -166.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -74.11 -55.1 0.09 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.113 0 C-N-CA 120.682 0.921 . . . . 0.0 110.761 -174.318 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -156.09 144.58 14.58 Favored Pre-proline 0 C--O 1.237 0.414 0 N-CA-C 106.091 -1.818 . . . . 0.0 106.091 -179.084 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -69.57 -29.52 24.66 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.053 1.835 . . . . 0.0 110.78 174.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -82.38 -15.53 52.39 Favored 'General case' 0 N--CA 1.455 -0.2 0 O-C-N 121.916 -0.49 . . . . 0.0 112.277 -171.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.6 tt -63.0 122.46 16.1 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 170.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 21.0 mm -103.09 109.25 26.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 N-CA-C 107.167 -1.42 . . . . 0.0 107.167 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.538 ' HE1' HD21 ' A' ' 31' ' ' ASN . 85.6 m95 -58.81 156.35 25.52 Favored Pre-proline 0 CA--C 1.542 0.644 0 C-N-CA 124.134 0.974 . . . . 0.0 111.079 179.471 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -66.92 170.26 45.43 Favored 'Cis proline' 0 N--CA 1.458 -0.604 0 C-N-CA 125.303 -0.707 . . . . 0.0 113.38 -4.358 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -136.5 168.75 18.88 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.591 0.71 . . . . 0.0 110.678 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 18.9 mt -136.01 103.57 5.4 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 125.826 1.651 . . . . 0.0 108.027 -174.084 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.5 tp -87.35 143.44 27.25 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 174.466 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.413 ' HG2' HD22 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -138.11 83.31 1.97 Allowed 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 119.992 1.269 . . . . 0.0 110.373 179.092 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -59.7 155.27 16.15 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 123.439 0.695 . . . . 0.0 111.714 -161.118 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.13 139.92 58.74 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-O 123.317 1.532 . . . . 0.0 108.694 -176.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 69.12 -33.65 0.31 Allowed Glycine 0 CA--C 1.533 1.177 0 C-N-CA 127.487 2.47 . . . . 0.0 113.805 -175.131 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 89.8 m -76.18 176.31 8.17 Favored 'General case' 0 C--O 1.24 0.59 0 CA-C-N 120.755 2.277 . . . . 0.0 111.03 177.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.5 m-80 -128.46 -22.52 3.34 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 124.858 1.263 . . . . 0.0 111.465 -176.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -66.37 111.08 3.34 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 107.929 -1.138 . . . . 0.0 107.929 -176.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.604 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 3.2 mm? -60.09 139.14 57.67 Favored 'General case' 0 CA--C 1.512 -0.506 0 N-CA-C 107.208 -1.405 . . . . 0.0 107.208 167.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.421 HD13 ' HA ' ' A' ' 26' ' ' LEU . 0.4 OUTLIER -103.85 87.46 1.53 Allowed Pre-proline 0 C--N 1.324 -0.506 0 N-CA-C 104.579 -2.378 . . . . 0.0 104.579 176.567 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -62.54 140.95 84.42 Favored 'Trans proline' 0 N--CA 1.452 -0.956 0 N-CA-C 108.147 -1.521 . . . . 0.0 108.147 170.725 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.8 mt -138.5 100.29 4.06 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 104.614 -2.365 . . . . 0.0 104.614 -177.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 63.8 mtt180 -59.09 -35.93 74.24 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 118.352 0.524 . . . . 0.0 111.206 -175.038 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 15.0 t -161.66 -178.93 6.88 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 123.628 0.771 . . . . 0.0 109.018 -175.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.538 HD21 ' HE1' ' A' ' 13' ' ' TRP . 4.5 t-20 -57.84 -28.36 64.03 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 125.497 1.519 . . . . 0.0 112.587 -179.33 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -61.52 -41.16 96.92 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.702 -0.624 . . . . 0.0 109.981 176.126 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -66.34 -30.84 71.32 Favored 'General case' 0 CA--C 1.522 -0.117 0 C-N-CA 123.783 0.833 . . . . 0.0 110.925 -175.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 63.5 t-105 -74.48 -43.09 57.64 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.671 0.788 . . . . 0.0 111.061 173.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -63.3 -35.44 80.38 Favored 'General case' 0 CA--C 1.528 0.13 0 O-C-N 121.698 -0.627 . . . . 0.0 110.283 176.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 63.2 mtt180 -60.76 -19.67 59.66 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.511 1.124 . . . . 0.0 112.357 173.204 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -64.98 -72.52 0.15 Allowed 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 120.255 1.389 . . . . 0.0 109.686 171.275 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 26.1 p -64.34 -20.66 66.25 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 120.882 -1.136 . . . . 0.0 113.267 -176.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.84 -28.19 69.85 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 122.985 0.514 . . . . 0.0 110.798 171.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -128.97 -16.11 4.16 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 -158.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.6 m -165.0 97.25 0.73 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 129.674 3.189 . . . . 0.0 109.95 171.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.7 mtpt -75.66 62.51 1.48 Allowed 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 125.703 1.601 . . . . 0.0 108.092 164.485 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -141.17 -171.76 3.35 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 125.001 1.321 . . . . 0.0 108.541 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . 0.3 16.4 mt 59.73 -157.39 0.33 Allowed 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 124.866 1.266 . . . . 0.0 111.975 -178.866 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.8 mt 75.22 84.11 0.1 Allowed 'General case' 0 CA--C 1.511 -0.529 0 C-N-CA 127.008 2.123 . . . . 0.0 109.826 162.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -88.63 152.0 22.11 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 113.779 -1.555 . . . . 0.0 109.577 -175.419 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.431 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 1.4 m-85 -71.54 93.27 1.19 Allowed 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 173.584 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 141.85 -5.27 2.24 Favored Glycine 0 N--CA 1.443 -0.891 0 CA-C-O 117.824 -1.542 . . . . 0.0 113.816 -163.006 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.55 -7.49 44.25 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 116.684 2.105 . . . . 0.0 116.684 -164.328 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.0 tppt? 44.65 130.89 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 131.405 3.882 . . . . 0.0 116.213 -174.252 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.1 mt -117.52 152.52 34.92 Favored 'General case' 0 C--N 1.331 -0.238 0 O-C-N 120.776 -1.202 . . . . 0.0 107.995 164.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 54.1 t -133.82 141.49 43.92 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 105.817 -1.919 . . . . 0.0 105.817 167.577 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -109.49 174.84 5.68 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 125.489 1.516 . . . . 0.0 110.448 175.313 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.2 m -60.89 -17.11 48.69 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -179.318 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -98.03 11.08 38.75 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.836 1.254 . . . . 0.0 111.308 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 64.54 24.75 13.12 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.023 1.729 . . . . 0.0 111.987 176.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 32.8 m80 -75.65 114.97 14.83 Favored 'General case' 0 C--N 1.332 -0.186 0 O-C-N 120.43 -1.418 . . . . 0.0 107.711 166.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.506 ' SG ' HD13 ' A' ' 73' ' ' LEU . 1.3 m -73.1 153.86 40.63 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 122.129 0.966 . . . . 0.0 108.949 161.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -140.33 157.54 45.39 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 126.359 1.864 . . . . 0.0 106.846 171.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 79.0 t -129.0 148.79 33.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 106.155 -1.794 . . . . 0.0 106.155 167.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 18.3 tp -86.93 144.14 27.08 Favored 'General case' 0 CA--C 1.521 -0.163 0 C-N-CA 125.925 1.69 . . . . 0.0 109.137 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -116.03 165.19 13.4 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 124.402 1.081 . . . . 0.0 110.359 -175.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.431 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 0.1 OUTLIER -68.18 -14.49 63.02 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 173.798 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -81.02 16.14 1.6 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.581 1.553 . . . . 0.0 111.823 173.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 45.78 37.36 3.38 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 126.854 2.062 . . . . 0.0 112.411 -178.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.1 p-80 -125.6 170.28 11.64 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 172.322 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 62.4 m95 -111.71 127.57 55.82 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 107.203 -1.406 . . . . 0.0 107.203 175.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -97.76 145.79 30.34 Favored Pre-proline 0 CA--C 1.537 0.481 0 C-N-CA 123.975 0.91 . . . . 0.0 108.966 178.201 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.26 116.01 4.52 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 123.376 2.717 . . . . 0.0 110.881 175.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -117.87 57.37 0.83 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.863 1.665 . . . . 0.0 109.568 -170.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.11 156.24 0.14 Allowed Pre-proline 0 CA--C 1.538 0.497 0 C-N-CA 129.731 3.213 . . . . 0.0 114.147 178.01 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -72.07 169.85 20.4 Favored 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 121.765 1.643 . . . . 0.0 110.355 161.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.506 HD13 ' SG ' ' A' ' 58' ' ' CYS . 11.3 tp -126.21 144.66 49.82 Favored Pre-proline 0 N--CA 1.451 -0.42 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.922 -167.006 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -69.95 165.28 31.72 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 121.614 1.542 . . . . 0.0 111.52 176.324 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -56.47 -31.11 84.79 Favored 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 123.434 2.756 . . . . 0.0 113.388 174.134 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -81.72 -15.96 52.7 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.278 1.031 . . . . 0.0 112.242 176.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -76.75 -22.15 72.83 Favored Glycine 0 CA--C 1.527 0.794 0 O-C-N 121.763 -0.586 . . . . 0.0 112.104 -174.191 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 29.7 tp -63.49 -48.53 77.24 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 121.694 -0.886 . . . . 0.0 109.6 164.229 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -53.86 -37.77 64.0 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 118.695 -0.669 . . . . 0.0 111.479 175.266 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -60.4 -34.38 73.84 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.564 1.075 . . . . 0.0 113.053 177.468 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.9 mp -67.8 -64.07 0.93 Allowed 'General case' 0 N--CA 1.456 -0.127 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 172.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.9 mm -60.58 -26.96 39.31 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 C-N-CA 123.681 0.792 . . . . 0.0 111.538 -170.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -44.98 -41.62 7.5 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 125.415 1.486 . . . . 0.0 110.905 168.755 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.56 -63.58 1.09 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.771 1.228 . . . . 0.0 111.522 176.323 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.604 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 7.4 t60 -55.77 -40.1 72.15 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.368 1.067 . . . . 0.0 111.267 -177.222 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 23.7 m -68.46 -51.81 39.5 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 120.38 -1.45 . . . . 0.0 110.301 177.326 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.74 -33.24 75.42 Favored 'General case' 0 C--N 1.339 0.137 0 CA-C-N 119.099 0.863 . . . . 0.0 111.887 -175.522 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.3 t -71.13 -28.41 64.27 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 118.403 -0.808 . . . . 0.0 109.302 -176.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 98.1 mt -88.4 -56.68 3.21 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 124.478 1.111 . . . . 0.0 110.858 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 142.99 9.45 0.51 Allowed Glycine 0 CA--C 1.532 1.118 0 CA-C-O 117.96 -1.467 . . . . 0.0 114.38 -172.101 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 7.3 m-70 -95.28 152.5 18.32 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 120.456 2.128 . . . . 0.0 111.877 -173.562 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 1.8 t -155.49 89.57 1.2 Allowed 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 125.46 1.504 . . . . 0.0 109.311 169.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 21.2 p 46.57 174.47 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.461 1 C-N-CA 131.949 4.1 . . . . 0.0 117.356 176.115 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 9.4 t -167.53 76.76 0.16 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 128.154 2.582 . . . . 0.0 106.981 -175.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.9 t 72.02 145.64 0.07 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 127.565 2.346 . . . . 0.0 112.444 -175.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.503 ' HE3' ' HB2' ' A' ' 100' ' ' HIS . 7.4 ttpt 62.85 177.59 0.15 Allowed 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 126.289 1.835 . . . . 0.0 111.856 -175.005 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 7.7 ptm -75.98 62.13 1.59 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.888 1.675 . . . . 0.0 112.022 -171.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 65.35 -72.49 0.07 Allowed 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 126.029 1.732 . . . . 0.0 110.276 -168.666 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 77.7 mt -147.4 134.71 20.64 Favored 'General case' 0 CA--C 1.512 -0.499 0 C-N-CA 124.947 1.299 . . . . 0.0 107.664 -174.259 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' HIS . . . . . 0.503 ' HB2' ' HE3' ' A' ' 96' ' ' LYS . 51.9 t-80 -61.92 -48.08 82.05 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 122.04 0.924 . . . . 0.0 110.536 178.551 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 2.8 m -164.82 -178.17 5.11 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.767 1.227 . . . . 0.0 111.296 -169.07 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 63.2 t -64.54 -38.24 82.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 CA-C-O 118.47 -0.776 . . . . 0.0 110.659 -176.277 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.01 -50.44 61.37 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 119.257 0.935 . . . . 0.0 109.122 177.002 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -65.53 -36.29 83.36 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.858 1.263 . . . . 0.0 110.307 -175.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.3 -48.5 81.09 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.999 0.519 . . . . 0.0 110.48 176.261 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 20.2 mm -65.24 -28.35 44.34 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 -178.175 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -69.8 -48.4 59.27 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.198 -0.939 . . . . 0.0 109.415 173.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -57.79 -65.11 0.69 Allowed 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 125.781 1.632 . . . . 0.0 111.629 -179.344 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.4 mp -49.23 -33.95 13.83 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 126.237 1.815 . . . . 0.0 113.914 -175.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -62.18 -44.99 95.38 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 118.141 0.428 . . . . 0.0 112.049 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -82.52 -8.68 59.61 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -173.137 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . 0.275 3.2 tp -88.37 -50.54 6.26 Favored 'General case' 0 N--CA 1.4 -2.948 0 C-N-CA 128.352 2.661 . . . . 0.0 107.51 -179.441 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -67.15 154.38 41.39 Favored 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 124.064 0.852 . . . . 0.0 111.19 -161.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.091 0 CA-C-O 117.409 -1.773 . . . . 0.0 112.208 -172.926 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 38.9 tpp . . . . . 0 N--CA 1.466 0.364 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -169.14 -127.79 0.95 Allowed Glycine 0 N--CA 1.445 -0.762 0 N-CA-C 104.644 -3.383 . . . . 0.0 104.644 173.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -60.24 155.58 17.28 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 123.223 0.609 . . . . 0.0 110.579 169.014 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -118.93 101.25 0.86 Allowed Glycine 0 C--N 1.33 0.249 0 N-CA-C 106.871 -2.492 . . . . 0.0 106.871 170.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 -127.44 20.74 6.69 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.623 1.969 . . . . 0.0 109.535 177.849 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 20.6 p -141.52 153.24 65.26 Favored Pre-proline 0 CA--C 1.535 0.386 0 C-N-CA 124.902 1.281 . . . . 0.0 110.775 -162.329 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.98 -55.48 0.31 Allowed 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 120.928 1.086 . . . . 0.0 111.697 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -160.82 143.78 9.69 Favored Pre-proline 0 CA--C 1.534 0.362 0 CA-C-N 119.485 1.039 . . . . 0.0 110.29 -173.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -73.84 -23.49 16.43 Favored 'Trans proline' 0 CA--C 1.531 0.372 0 C-N-CA 121.446 1.431 . . . . 0.0 113.56 -176.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 -72.25 -28.74 63.34 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-O 116.899 -1.524 . . . . 0.0 111.974 172.324 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.5 tt -56.33 123.59 15.14 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 120.106 1.321 . . . . 0.0 110.939 -173.449 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 28.0 mm -106.25 97.19 5.31 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.145 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 -177.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.48 ' CH2' ' HB2' ' A' ' 34' ' ' TRP . 81.5 m95 -51.16 144.06 15.63 Favored Pre-proline 0 C--O 1.236 0.391 0 O-C-N 123.761 0.663 . . . . 0.0 111.057 174.756 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -75.87 169.71 73.77 Favored 'Cis proline' 0 N--CA 1.458 -0.58 0 N-CA-C 114.142 0.785 . . . . 0.0 114.142 8.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -138.02 171.33 14.57 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 121.282 0.563 . . . . 0.0 111.496 175.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 19.3 mt -137.58 109.17 6.99 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 125.966 1.706 . . . . 0.0 108.067 -173.19 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 13.4 tp -94.41 137.79 33.13 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.549 1.139 . . . . 0.0 108.678 175.632 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -130.88 84.89 2.22 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.678 1.126 . . . . 0.0 110.959 179.342 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -46.21 132.43 9.88 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 126.982 2.113 . . . . 0.0 110.004 -175.237 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -60.71 127.68 32.84 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 122.601 1.191 . . . . 0.0 110.117 177.634 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 99.06 -49.53 1.23 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 126.295 1.902 . . . . 0.0 110.106 -174.348 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 57.1 m -67.99 169.26 10.32 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 122.831 1.3 . . . . 0.0 111.11 -178.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -129.41 -30.59 2.12 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 125.346 1.459 . . . . 0.0 108.935 -178.094 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -72.83 98.62 2.47 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 126.538 1.935 . . . . 0.0 108.579 -172.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.489 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 2.0 mm? -53.87 152.29 5.71 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 123.638 0.775 . . . . 0.0 110.918 -173.365 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -105.54 86.61 1.82 Allowed Pre-proline 0 C--O 1.235 0.306 0 C-N-CA 124.907 1.283 . . . . 0.0 108.197 172.26 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -66.94 142.74 63.51 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 121.832 1.688 . . . . 0.0 109.139 168.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.7 mt -145.86 109.32 4.71 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 -179.452 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.8 mmt85 -60.04 -47.7 84.75 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 123.644 0.777 . . . . 0.0 110.571 -176.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 45.3 p -139.86 174.64 10.31 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 124.135 0.974 . . . . 0.0 109.306 -172.217 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.75 -20.87 66.09 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.96 0.504 . . . . 0.0 111.486 173.535 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 48.1 m-20 -55.52 -42.5 74.62 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 123.794 0.838 . . . . 0.0 108.766 171.267 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -81.75 -29.64 32.77 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 123.14 0.576 . . . . 0.0 111.672 -173.774 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.48 ' HB2' ' CH2' ' A' ' 13' ' ' TRP . 44.7 t-105 -56.88 -45.49 82.49 Favored 'General case' 0 CA--C 1.528 0.129 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 169.537 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 66.2 mm-40 -64.33 -47.65 78.56 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 123.047 0.539 . . . . 0.0 110.367 174.402 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 28.1 mtt180 -53.25 -27.05 20.39 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 118.164 -0.922 . . . . 0.0 113.43 178.166 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -60.3 -60.68 3.42 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 120.378 1.444 . . . . 0.0 110.564 175.198 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 6.0 p -73.92 -30.78 62.76 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 122.823 0.449 . . . . 0.0 111.183 -172.144 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -68.75 -17.25 64.01 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 125.543 1.537 . . . . 0.0 111.918 175.205 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -126.91 28.37 5.83 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.073 0.949 . . . . 0.0 111.834 -177.022 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 4.4 m 52.31 27.27 4.65 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.88 1.272 . . . . 0.0 114.179 168.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.6 mmtm -48.28 -60.91 2.29 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.006 1.322 . . . . 0.0 112.676 -168.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -153.54 -176.79 5.97 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 178.861 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.83 178.99 0.94 Allowed 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.823 0.849 . . . . 0.0 110.879 169.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 85.2 mt -131.27 117.11 18.5 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 105.244 -2.132 . . . . 0.0 105.244 165.167 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -117.12 152.0 35.65 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 125.469 1.508 . . . . 0.0 108.731 -177.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.428 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 11.7 m-85 -58.06 138.27 56.17 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 107.092 -1.448 . . . . 0.0 107.092 167.311 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.75 3.18 80.79 Favored Glycine 0 CA--C 1.529 0.962 0 CA-C-O 117.55 -1.694 . . . . 0.0 114.872 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -65.97 -10.66 41.37 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 120.231 2.016 . . . . 0.0 115.154 -170.25 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 53.68 127.92 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 129.67 3.188 . . . . 0.0 115.443 176.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 13.0 mt -113.21 157.24 21.98 Favored 'General case' 0 C--N 1.328 -0.363 0 O-C-N 121.007 -1.058 . . . . 0.0 108.45 165.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 47.7 t -146.05 138.32 20.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 C-N-CA 128.379 2.672 . . . . 0.0 104.146 177.067 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.8 p-10 -118.15 -179.1 3.67 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 124.725 1.21 . . . . 0.0 111.347 177.663 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.64 -7.7 16.54 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 177.637 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -100.75 5.29 43.57 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.787 1.635 . . . . 0.0 111.54 174.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 59.06 20.27 8.13 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.343 1.457 . . . . 0.0 111.402 -178.102 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 49.5 m170 -72.35 111.77 7.83 Favored 'General case' 0 C--O 1.233 0.232 0 O-C-N 120.283 -1.511 . . . . 0.0 107.789 171.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -78.65 147.78 33.45 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 175.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -142.64 143.65 32.45 Favored 'General case' 0 N--CA 1.435 -1.222 0 CA-C-N 113.114 -1.857 . . . . 0.0 107.248 -172.236 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 55.5 t -127.94 146.99 32.66 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 C-N-CA 128.519 2.728 . . . . 0.0 107.128 177.345 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 22.2 tp -87.96 138.76 31.17 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 124.926 1.291 . . . . 0.0 107.618 171.306 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -117.23 169.04 9.78 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 123.666 0.786 . . . . 0.0 111.39 176.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.428 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 20.6 mp0 -57.94 -24.67 58.95 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.359 1.464 . . . . 0.0 112.55 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -71.57 -0.51 10.81 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.508 1.123 . . . . 0.0 113.386 178.005 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 66.02 12.16 8.26 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 128.395 2.678 . . . . 0.0 113.883 -178.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.42 ' CD2' ' HD1' ' A' ' 68' ' ' HIS . 1.3 p-80 -99.56 179.95 4.39 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 124.36 1.064 . . . . 0.0 110.517 168.779 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 76.6 m95 -117.47 121.55 41.33 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.49 1.516 . . . . 0.0 107.02 175.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.42 ' HD1' ' CD2' ' A' ' 66' ' ' HIS . 0.2 OUTLIER -110.78 147.71 37.03 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 125.215 1.406 . . . . 0.0 111.804 179.208 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -67.16 145.72 73.83 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.903 2.402 . . . . 0.0 112.73 -170.2 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -138.04 43.78 2.2 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.48 1.112 . . . . 0.0 110.852 -172.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.52 164.6 0.13 Allowed Pre-proline 0 N--CA 1.47 0.575 0 C-N-CA 128.355 2.662 . . . . 0.0 113.779 175.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -69.73 168.64 20.93 Favored 'Trans proline' 0 N--CA 1.452 -0.961 0 C-N-CA 121.343 1.362 . . . . 0.0 111.367 167.403 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.3 tt -123.56 143.2 40.96 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 125.105 1.362 . . . . 0.0 108.51 -172.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -79.41 163.81 24.36 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.327 2.684 . . . . 0.0 112.178 -173.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.3 -7.88 17.09 Favored 'Trans proline' 0 CA--C 1.53 0.295 0 C-N-CA 123.119 2.546 . . . . 0.0 114.741 -178.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -106.71 -16.6 14.45 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.968 1.707 . . . . 0.0 112.398 173.439 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -67.03 -29.22 74.29 Favored Glycine 0 CA--C 1.531 1.07 0 CA-C-N 119.886 1.221 . . . . 0.0 112.281 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 30.7 tp -65.32 -50.58 65.12 Favored 'General case' 0 C--N 1.34 0.16 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.383 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -60.94 -30.57 70.3 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 125.57 1.548 . . . . 0.0 110.034 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -65.99 -47.93 72.89 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 119.281 0.946 . . . . 0.0 110.106 174.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 23.2 mt -64.61 -51.13 64.25 Favored 'General case' 0 CA--C 1.52 -0.177 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 -179.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 14.8 mm -58.77 -31.85 45.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 C-N-CA 123.633 0.773 . . . . 0.0 110.899 179.257 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -51.88 -38.91 57.95 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 119.914 1.233 . . . . 0.0 111.702 174.156 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.26 -57.65 10.38 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 118.811 0.732 . . . . 0.0 111.003 176.557 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.489 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 21.5 t60 -55.42 -46.72 76.66 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.323 1.049 . . . . 0.0 110.038 176.662 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 73.3 m -72.7 -24.22 60.97 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 120.589 -1.319 . . . . 0.0 112.917 -174.101 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -97.3 -8.94 28.55 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.512 1.125 . . . . 0.0 112.902 -177.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.5 t -89.71 -20.98 22.95 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 167.646 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 63.8 mt -115.63 -21.61 9.61 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -176.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 101.22 19.74 15.71 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 115.679 1.031 . . . . 0.0 115.679 172.008 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' HIS . . . . . 0.763 ' CD2' HD13 ' A' ' 112' ' ' LEU . 10.4 m-70 -79.71 -31.28 41.19 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 -158.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 18.8 m 54.73 -176.55 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.553 1.541 . . . . 0.0 113.763 -172.143 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 3.8 m -83.19 173.29 11.79 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.273 1.029 . . . . 0.0 109.603 165.461 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -149.39 -62.59 0.22 Allowed 'General case' 0 C--O 1.235 0.334 0 C-N-CA 123.79 0.836 . . . . 0.0 109.649 173.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 10.0 m -70.93 -161.73 0.06 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 127.324 2.25 . . . . 0.0 110.634 177.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 47.1 pttt -58.24 128.29 36.38 Favored 'General case' 0 N--CA 1.464 0.244 0 O-C-N 120.695 -1.253 . . . . 0.0 108.301 170.371 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . 0.25 2.6 ptm 44.73 -163.48 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.972 2.109 . . . . 0.0 112.807 -175.645 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.42 -68.31 0.33 Allowed 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 168.722 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.52 HD13 ' HB2' ' A' ' 105' ' ' ALA . 81.1 mt -141.27 142.74 33.88 Favored 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -168.245 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 1.4 m170 -75.64 -36.37 60.22 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 125.038 1.461 . . . . 0.0 110.357 -174.712 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.6 p -164.2 -173.93 3.33 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.963 1.305 . . . . 0.0 109.977 169.354 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 87.7 t -60.8 -41.41 88.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 C-N-CA 124.783 1.233 . . . . 0.0 111.059 176.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.9 -46.01 78.48 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 119.677 1.126 . . . . 0.0 110.032 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -66.01 -34.26 77.69 Favored 'General case' 0 C--O 1.227 -0.098 0 C-N-CA 123.138 0.575 . . . . 0.0 110.651 178.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.52 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -55.99 -53.04 61.77 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 123.244 0.618 . . . . 0.0 110.551 175.377 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 30.9 mm -60.86 -34.07 57.95 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 C-N-CA 123.275 0.63 . . . . 0.0 109.805 -176.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -81.15 -27.35 35.49 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.948 0.722 . . . . 0.0 112.948 178.419 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.431 ' CE2' HD11 ' A' ' 112' ' ' LEU . 29.0 t80 -67.33 -65.43 0.69 Allowed 'General case' 0 C--O 1.224 -0.255 0 C-N-CA 125.299 1.44 . . . . 0.0 107.976 172.813 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.525 ' HA ' HD12 ' A' ' 112' ' ' LEU . 8.9 mp -49.88 -46.18 51.35 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.359 1.464 . . . . 0.0 112.019 -176.915 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -69.52 -19.94 63.71 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 119.171 0.896 . . . . 0.0 113.166 -179.211 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -93.41 -19.34 21.39 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 123.814 0.846 . . . . 0.0 111.541 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.763 HD13 ' CD2' ' A' ' 91' ' ' HIS . 42.1 mt -71.63 -56.49 5.74 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.404 1.082 . . . . 0.0 109.771 177.383 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -65.97 151.08 47.59 Favored 'General case' 0 C--O 1.24 0.556 0 CA-C-O 121.502 0.668 . . . . 0.0 111.13 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.065 0 CA-C-O 117.183 -1.898 . . . . 0.0 109.991 -171.075 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.5 ptp . . . . . 0 N--CA 1.472 0.63 0 CA-C-O 119.003 -0.522 . . . . 0.0 109.803 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 82.05 46.19 6.75 Favored Glycine 0 C--N 1.337 0.622 0 N-CA-C 110.104 -1.198 . . . . 0.0 110.104 -170.2 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -152.09 164.66 36.81 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 125.435 1.494 . . . . 0.0 109.532 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -125.28 -150.55 7.79 Favored Glycine 0 CA--C 1.523 0.566 0 C-N-CA 125.426 1.488 . . . . 0.0 110.512 -176.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -140.7 104.15 4.66 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 105.668 -1.975 . . . . 0.0 105.668 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 35.6 p -134.95 148.48 67.08 Favored Pre-proline 0 C--O 1.242 0.688 0 C-N-CA 125.272 1.429 . . . . 0.0 107.954 171.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -77.77 76.21 4.41 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 122.569 2.179 . . . . 0.0 110.014 -177.325 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 75.22 144.63 0.11 Allowed Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 128.052 2.541 . . . . 0.0 112.048 -178.622 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -82.79 -25.96 2.69 Favored 'Trans proline' 0 CA--C 1.538 0.682 0 C-N-CA 122.743 2.296 . . . . 0.0 112.836 174.636 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -74.67 -18.06 60.59 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 121.226 -0.921 . . . . 0.0 111.891 176.306 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.7 tt -61.84 115.22 3.84 Favored 'General case' 0 C--N 1.34 0.18 0 N-CA-C 107.175 -1.417 . . . . 0.0 107.175 167.424 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 23.7 mm -98.3 116.05 40.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 N-CA-C 106.71 -1.589 . . . . 0.0 106.71 174.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -62.44 154.18 73.46 Favored Pre-proline 0 C--O 1.239 0.551 0 CA-C-O 119.558 -0.258 . . . . 0.0 110.347 175.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -66.92 166.59 61.24 Favored 'Cis proline' 0 N--CA 1.458 -0.602 0 N-CA-C 114.615 0.967 . . . . 0.0 114.615 -0.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -131.87 168.09 18.45 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 123.438 0.695 . . . . 0.0 110.732 176.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.515 HD22 HD12 ' A' ' 25' ' ' LEU . 12.3 mt -138.93 94.79 2.86 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 126.084 1.754 . . . . 0.0 108.209 -175.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.2 tp -74.59 142.12 44.67 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 171.283 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.43 97.18 3.0 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 174.587 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -56.69 154.59 8.73 Favored 'General case' 0 N--CA 1.444 -0.734 0 O-C-N 124.436 1.085 . . . . 0.0 112.189 -169.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -68.53 124.77 24.5 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 114.672 -1.149 . . . . 0.0 108.61 174.457 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 99.02 -46.84 1.42 Allowed Glycine 0 CA--C 1.518 0.28 0 C-N-CA 125.383 1.468 . . . . 0.0 111.518 178.476 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 76.0 m -76.36 175.16 9.38 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 122.312 1.054 . . . . 0.0 111.231 178.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -125.88 -22.99 4.05 Favored 'General case' 0 C--N 1.334 -0.095 0 C-N-CA 125.164 1.386 . . . . 0.0 110.499 -174.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -62.95 121.2 12.96 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 124.732 1.213 . . . . 0.0 108.988 -177.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.515 HD12 HD22 ' A' ' 16' ' ' LEU . 3.7 mm? -74.16 150.68 40.3 Favored 'General case' 0 N--CA 1.454 -0.254 0 O-C-N 121.019 -1.051 . . . . 0.0 109.916 172.332 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -111.25 86.87 6.8 Favored Pre-proline 0 CA--C 1.532 0.279 0 C-N-CA 124.689 1.196 . . . . 0.0 108.717 173.185 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -64.39 132.88 35.16 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 121.682 1.588 . . . . 0.0 108.973 174.205 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.8 mt -134.56 101.28 4.9 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 -178.323 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.16 -38.14 87.36 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 118.559 0.618 . . . . 0.0 111.058 -169.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.0 t -151.77 180.0 7.94 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 121.964 0.887 . . . . 0.0 110.418 172.166 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.64 -28.79 68.83 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 125.081 1.352 . . . . 0.0 112.613 -173.414 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -59.5 -39.8 85.01 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.015 0.825 . . . . 0.0 110.439 178.255 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -60.76 -48.58 81.18 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 124.611 1.165 . . . . 0.0 109.692 177.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 25.4 t-105 -58.69 -47.96 82.74 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 123.401 0.68 . . . . 0.0 111.322 175.368 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -64.61 -28.34 69.56 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 123.238 0.615 . . . . 0.0 110.982 -176.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.9 mtp-105 -75.83 -38.59 57.92 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.392 0.677 . . . . 0.0 112.034 168.481 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 20.7 t80 -61.61 -63.05 1.4 Allowed 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.377 1.071 . . . . 0.0 109.685 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 28.8 p -71.87 -21.63 61.63 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -172.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.94 -55.43 29.58 Favored 'General case' 0 C--N 1.333 -0.126 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 172.444 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -74.75 3.05 8.64 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 177.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 62.0 m 60.52 -46.58 0.1 Allowed 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 128.9 2.88 . . . . 0.0 113.497 -163.307 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.36 -39.49 0.15 Allowed 'General case' 0 CA--C 1.519 -0.215 0 C-N-CA 130.611 3.564 . . . . 0.0 112.791 -171.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -154.89 -178.36 7.17 Favored 'General case' 0 N--CA 1.428 -1.542 0 C-N-CA 126.118 1.767 . . . . 0.0 111.564 178.264 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.54 118.93 10.18 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 126.444 1.898 . . . . 0.0 108.593 162.359 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.0 mt -92.01 120.35 32.57 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 174.561 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -111.56 148.49 33.13 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 124.498 1.119 . . . . 0.0 109.755 -170.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.403 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 13.0 m-85 -57.96 134.84 56.71 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 161.553 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 89.56 3.86 74.11 Favored Glycine 0 CA--C 1.531 1.057 0 CA-C-O 118.526 -1.152 . . . . 0.0 115.256 -177.179 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -70.25 -2.7 14.11 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 120.206 2.003 . . . . 0.0 115.675 -170.274 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.4 ttmm 45.96 117.28 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 130.94 3.696 . . . . 0.0 115.685 170.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 12.9 mt -103.35 159.79 15.26 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.324 167.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 91.1 t -137.0 154.91 31.95 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 C-N-CA 127.369 2.267 . . . . 0.0 105.09 163.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -123.69 -177.25 3.68 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.966 2.106 . . . . 0.0 111.496 -178.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.71 3.03 4.43 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.796 1.639 . . . . 0.0 113.247 178.246 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -123.55 16.71 9.63 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.696 1.998 . . . . 0.0 111.111 177.001 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 62.74 18.89 11.03 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.904 1.282 . . . . 0.0 111.889 175.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -70.87 108.47 4.52 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 119.959 -1.713 . . . . 0.0 108.672 170.25 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 56.5 m -69.49 151.06 46.5 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 119.451 -0.899 . . . . 0.0 108.576 164.521 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -137.37 161.07 37.28 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 125.241 1.416 . . . . 0.0 108.252 169.606 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 25.6 t -134.78 137.67 50.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 C-N-CA 130.288 3.435 . . . . 0.0 106.018 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 16.1 tp -85.84 133.21 33.98 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 170.273 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -110.1 174.31 5.92 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.534 1.134 . . . . 0.0 110.843 176.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.403 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 52.6 mt-10 -59.9 -18.61 46.11 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.989 1.716 . . . . 0.0 112.682 176.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -76.3 -7.62 55.32 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.167 0.987 . . . . 0.0 112.033 173.254 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 60.3 6.76 1.09 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 128.854 2.861 . . . . 0.0 114.815 -171.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 2.1 p-80 -76.11 161.78 28.56 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 119.641 1.11 . . . . 0.0 110.261 164.148 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 66.1 m95 -103.72 90.77 3.75 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 125.276 1.43 . . . . 0.0 107.943 176.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -78.62 163.41 61.28 Favored Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 124.53 1.132 . . . . 0.0 110.867 179.082 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.64 162.13 40.43 Favored 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.337 2.025 . . . . 0.0 110.595 -176.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -150.34 45.08 0.88 Allowed 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.348 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 69.03 165.11 0.13 Allowed Pre-proline 0 C--O 1.239 0.548 0 C-N-CA 127.375 2.27 . . . . 0.0 111.193 -174.193 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -72.82 -175.73 2.02 Favored 'Trans proline' 0 N--CA 1.447 -1.231 0 C-N-CA 121.409 1.406 . . . . 0.0 109.726 162.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.403 HD21 ' C ' ' A' ' 77' ' ' GLY . 8.4 tt -129.78 143.41 48.91 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 124.615 1.166 . . . . 0.0 107.935 -174.548 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -81.54 166.41 17.76 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.85 2.367 . . . . 0.0 110.645 -175.066 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -60.5 -26.36 82.63 Favored 'Trans proline' 0 CA--C 1.536 0.599 0 C-N-CA 121.153 1.236 . . . . 0.0 112.588 179.022 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -84.29 -18.0 37.79 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 124.892 1.277 . . . . 0.0 113.078 176.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.403 ' C ' HD21 ' A' ' 73' ' ' LEU . . . -72.45 -25.02 75.29 Favored Glycine 0 C--N 1.341 0.83 0 N-CA-C 111.225 -0.75 . . . . 0.0 111.225 -173.863 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 26.8 tp -65.02 -49.63 69.43 Favored 'General case' 0 C--N 1.339 0.131 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 177.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -56.58 -39.34 73.34 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.066 0.947 . . . . 0.0 109.304 173.157 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -65.9 -34.32 77.85 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.696 0.798 . . . . 0.0 112.146 178.612 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.7 mp -62.17 -64.0 1.07 Allowed 'General case' 0 C--N 1.34 0.173 0 O-C-N 121.076 -1.015 . . . . 0.0 109.044 168.424 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.467 HD12 HD11 ' A' ' 109' ' ' LEU . 32.9 mm -60.37 -26.96 38.68 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 123.167 0.587 . . . . 0.0 110.987 -170.38 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.74 -41.08 6.55 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 125.921 1.688 . . . . 0.0 111.714 169.685 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.45 -57.79 7.43 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 118.949 0.795 . . . . 0.0 110.765 -176.562 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.42 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 13.8 t60 -54.62 -48.01 72.73 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.659 1.184 . . . . 0.0 110.112 174.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 58.3 m -65.29 -37.01 85.83 Favored 'General case' 0 C--O 1.225 -0.199 0 O-C-N 120.849 -1.157 . . . . 0.0 111.231 -177.46 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -77.95 -16.91 57.78 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 119.154 0.888 . . . . 0.0 112.525 -178.099 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . 0.257 2.0 t -89.53 -30.27 18.34 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 119.51 1.05 . . . . 0.0 110.035 174.478 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 80.0 mt -96.07 -9.69 30.25 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 119.403 1.001 . . . . 0.0 112.966 178.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 73.16 28.82 65.57 Favored Glycine 0 CA--C 1.527 0.843 0 C-N-CA 125.453 1.501 . . . . 0.0 113.822 -178.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' HIS . . . . . 0.428 ' ND1' HD13 ' A' ' 112' ' ' LEU . 35.9 m170 -80.05 169.93 17.15 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 118.497 1.149 . . . . 0.0 111.871 -176.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 70.9 m -111.63 162.27 15.36 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.643 1.577 . . . . 0.0 110.563 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 16.4 p -83.05 6.2 19.73 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 114.417 1.266 . . . . 0.0 114.417 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 23.4 p 60.21 -164.78 0.22 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.091 0.957 . . . . 0.0 110.475 175.259 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 35.0 m -86.7 -173.04 4.29 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 164.212 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 64.13 27.26 14.05 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 119.386 0.994 . . . . 0.0 112.674 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 8.3 tmm? 44.84 71.69 0.25 Allowed 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.617 1.567 . . . . 0.0 110.573 177.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 66.6 m80 58.98 -85.48 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.52 1.128 . . . . 0.0 111.189 -166.042 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.639 HD13 ' HB2' ' A' ' 105' ' ' ALA . 97.8 mt -148.93 134.6 18.75 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.133 0.973 . . . . 0.0 108.883 -152.744 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 41.4 t-80 -69.39 -39.2 78.13 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 120.869 0.366 . . . . 0.0 111.253 178.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 5.2 t -164.29 -174.14 3.39 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.194 1.398 . . . . 0.0 108.895 176.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 88.9 t -61.05 -37.68 77.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 C-N-CA 125.622 1.569 . . . . 0.0 111.585 -176.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 11.4 ttm -57.56 -48.19 80.0 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 118.933 0.788 . . . . 0.0 110.286 177.262 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -54.34 -41.35 68.99 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 125.704 1.602 . . . . 0.0 110.254 -177.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.639 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -54.47 -47.9 72.41 Favored 'General case' 0 C--O 1.227 -0.113 0 C-N-CA 125.026 1.33 . . . . 0.0 111.766 177.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 38.5 mm -61.73 -43.72 97.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 -176.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -68.08 -34.49 76.5 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 118.671 -0.681 . . . . 0.0 111.398 178.414 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.492 ' CE2' HD11 ' A' ' 112' ' ' LEU . 33.0 t80 -60.47 -65.57 0.67 Allowed 'General case' 0 C--O 1.226 -0.133 0 C-N-CA 123.889 0.876 . . . . 0.0 109.433 174.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.467 HD11 HD12 ' A' ' 82' ' ' ILE . 8.0 mp -48.16 -49.91 30.77 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 125.246 1.418 . . . . 0.0 111.766 178.194 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 16.7 m-80 -65.54 -31.7 72.89 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 118.781 -0.628 . . . . 0.0 112.358 -178.409 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -75.86 -27.46 57.8 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 117.985 -1.007 . . . . 0.0 111.292 176.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.492 HD11 ' CE2' ' A' ' 108' ' ' PHE . 59.8 mt -63.4 -64.68 0.84 Allowed 'General case' 0 N--CA 1.457 -0.111 0 CA-C-N 119.406 1.003 . . . . 0.0 108.789 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 44.56 50.78 8.22 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 126.144 1.777 . . . . 0.0 111.445 -169.048 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.677 0 N-CA-C 108.774 -1.731 . . . . 0.0 108.774 167.917 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.4 ttm . . . . . 0 N--CA 1.469 0.486 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -64.68 162.11 38.53 Favored Glycine 0 C--N 1.339 0.745 0 CA-C-N 119.681 1.128 . . . . 0.0 110.874 172.222 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -145.92 106.99 4.15 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 124.489 1.116 . . . . 0.0 108.004 179.086 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 75.66 160.02 8.67 Favored Glycine 0 C--N 1.33 0.242 0 N-CA-C 110.019 -1.232 . . . . 0.0 110.019 -161.678 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 60.97 9.44 2.31 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 115.246 1.572 . . . . 0.0 115.246 170.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 29.3 p -70.16 144.81 92.96 Favored Pre-proline 0 C--N 1.324 -0.505 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 157.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -73.49 94.63 0.85 Allowed 'Trans proline' 0 N--CA 1.444 -1.432 0 C-N-CA 121.837 1.691 . . . . 0.0 108.728 174.635 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 75.17 147.27 0.12 Allowed Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 128.35 2.66 . . . . 0.0 111.873 -174.311 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -79.39 -32.35 1.73 Allowed 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 123.264 2.643 . . . . 0.0 112.379 170.868 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -83.87 -6.6 59.46 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.851 1.26 . . . . 0.0 112.764 -176.04 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.44 132.29 49.6 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.838 1.255 . . . . 0.0 108.105 164.552 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.8 mm -115.33 115.83 50.61 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.131 0 C-N-CA 124.823 1.249 . . . . 0.0 107.966 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 71.2 m95 -60.6 151.33 71.44 Favored Pre-proline 0 C--O 1.235 0.296 0 C-N-CA 123.494 0.718 . . . . 0.0 111.725 177.106 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -72.32 174.15 49.54 Favored 'Cis proline' 0 CA--C 1.537 0.65 0 N-CA-C 115.266 1.218 . . . . 0.0 115.266 0.052 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -128.81 166.77 18.39 Favored 'General case' 0 C--N 1.344 0.339 0 C-N-CA 123.39 0.676 . . . . 0.0 112.817 -179.553 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 18.1 mt -139.49 99.63 3.78 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 127.795 2.438 . . . . 0.0 107.937 178.568 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 23.8 tp -70.44 152.95 43.49 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 117.883 -1.056 . . . . 0.0 108.444 169.41 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.424 ' HG2' ' HG ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -144.87 85.95 1.77 Allowed 'General case' 0 C--O 1.234 0.267 0 CA-C-N 120.238 1.381 . . . . 0.0 111.588 170.805 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -44.45 127.28 5.82 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 125.728 1.611 . . . . 0.0 110.517 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.4 tp60 -68.49 90.77 0.39 Allowed 'General case' 0 N--CA 1.432 -1.366 0 C-N-CA 126.036 1.735 . . . . 0.0 111.142 -170.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 115.06 -17.55 17.12 Favored Glycine 0 CA--C 1.524 0.627 0 CA-C-O 118.267 -1.296 . . . . 0.0 112.173 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.422 ' C ' ' H ' ' A' ' 24' ' ' GLU . 3.8 t -71.38 -33.35 69.45 Favored 'General case' 0 C--O 1.22 -0.454 0 CA-C-N 118.881 1.341 . . . . 0.0 109.957 173.909 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.605 ' HB3' ' HB1' ' A' ' 84' ' ' ALA . 7.9 m-80 68.7 -20.83 0.15 Allowed 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.908 1.683 . . . . 0.0 112.552 -172.55 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.422 ' H ' ' C ' ' A' ' 22' ' ' CYS . 23.3 tt0 -64.86 138.26 58.27 Favored 'General case' 0 N--CA 1.441 -0.918 0 C-N-CA 125.308 1.443 . . . . 0.0 108.352 172.865 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.757 HD13 HD13 ' A' ' 82' ' ' ILE . 1.3 mt -96.98 150.6 20.58 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 124.164 0.986 . . . . 0.0 108.519 169.878 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -113.73 87.83 12.85 Favored Pre-proline 0 C--N 1.327 -0.403 0 C-N-CA 124.768 1.227 . . . . 0.0 110.226 175.104 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -64.23 137.43 56.33 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 123.083 2.522 . . . . 0.0 109.994 176.151 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.7 mt -141.47 117.12 10.32 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 106.783 -1.562 . . . . 0.0 106.783 -177.404 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -69.0 -53.59 19.74 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.235 0.541 . . . . 0.0 112.03 -173.172 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 64.3 p -138.85 165.11 27.89 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.983 0.913 . . . . 0.0 108.612 -175.378 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -50.59 -30.85 14.25 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 123.384 0.674 . . . . 0.0 112.652 -177.37 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.9 -42.54 76.15 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.257 1.023 . . . . 0.0 111.595 174.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.44 -47.32 79.53 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 121.216 -0.927 . . . . 0.0 110.484 179.038 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 41.0 t-105 -58.06 -47.04 84.35 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 176.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 -55.09 -58.41 7.76 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.474 0.709 . . . . 0.0 109.444 178.211 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -64.64 -14.66 59.07 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 125.336 1.455 . . . . 0.0 113.587 -178.166 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.47 ' CZ ' ' CD2' ' A' ' 43' ' ' HIS . 44.8 t80 -79.1 -63.39 1.43 Allowed 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 173.762 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 8.7 t -66.48 -29.32 69.41 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.295 -0.878 . . . . 0.0 111.586 -176.076 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.78 -13.82 62.47 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 124.531 1.132 . . . . 0.0 112.091 -178.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -109.93 6.16 22.98 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 119.322 0.965 . . . . 0.0 111.737 -174.629 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 48.84 40.32 16.16 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.865 1.666 . . . . 0.0 111.936 -170.46 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -51.45 -42.12 61.34 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 123.499 0.72 . . . . 0.0 111.241 178.055 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.47 ' CD2' ' CZ ' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -151.1 -167.17 2.74 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.45 1.5 . . . . 0.0 107.622 -173.488 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.564 HD12 ' N ' ' A' ' 44' ' ' LEU . 1.7 mp -123.51 125.34 44.72 Favored 'General case' 0 CA--C 1.513 -0.475 0 C-N-CA 124.807 1.243 . . . . 0.0 109.734 -178.285 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 85.1 mt -82.67 134.99 35.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.308 0.575 . . . . 0.0 109.637 171.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -149.85 162.33 40.51 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.616 1.166 . . . . 0.0 109.051 -173.301 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -71.39 105.01 3.37 Favored 'General case' 0 C--O 1.237 0.443 0 O-C-N 121.612 -0.68 . . . . 0.0 109.217 -163.542 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 122.47 5.31 8.61 Favored Glycine 0 CA--C 1.526 0.748 0 CA-C-O 117.433 -1.759 . . . . 0.0 114.787 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.95 -15.58 1.45 Allowed 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 117.255 2.317 . . . . 0.0 117.255 -175.476 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.5 ttmt 44.63 125.67 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.221 1 C-N-CA 132.171 4.188 . . . . 0.0 115.295 -177.005 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.7 mt -109.99 139.42 45.11 Favored 'General case' 0 CA--C 1.512 -0.51 0 O-C-N 120.942 -1.099 . . . . 0.0 108.089 166.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 55.2 t -113.01 151.29 14.92 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 N-CA-C 105.098 -2.186 . . . . 0.0 105.098 162.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -131.22 172.19 12.42 Favored 'General case' 0 N--CA 1.437 -1.118 0 C-N-CA 130.294 3.438 . . . . 0.0 108.617 -177.218 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.7 t -56.71 -20.69 23.11 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.36 1.464 . . . . 0.0 113.048 177.564 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -98.35 -0.09 44.43 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.096 1.758 . . . . 0.0 112.619 -169.641 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 59.63 15.3 4.55 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.989 1.716 . . . . 0.0 112.54 -171.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 48.1 m170 -70.18 106.4 3.28 Favored 'General case' 0 CA--C 1.529 0.15 0 O-C-N 120.076 -1.64 . . . . 0.0 109.638 164.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 2.9 t -71.86 151.57 43.3 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 174.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -139.1 153.77 48.06 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 124.55 1.14 . . . . 0.0 108.757 176.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 27.8 t -141.91 135.41 29.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 C-N-CA 127.526 2.33 . . . . 0.0 107.336 -176.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 29.5 tp -80.7 133.44 35.69 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 126.051 1.74 . . . . 0.0 107.719 176.214 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -125.83 170.35 11.71 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.14 0.976 . . . . 0.0 109.441 178.226 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -66.57 -29.3 69.34 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.12 0.968 . . . . 0.0 112.001 -167.547 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -66.73 8.8 0.22 Allowed 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.795 1.238 . . . . 0.0 112.954 171.72 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 63.48 28.25 15.31 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 126.434 1.894 . . . . 0.0 111.674 168.38 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.4 p80 -114.75 166.52 11.66 Favored 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 124.948 1.299 . . . . 0.0 110.191 170.299 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 65.3 m95 -103.71 98.09 8.01 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 126.638 1.975 . . . . 0.0 106.785 174.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 63.3 t-80 -71.08 143.52 88.79 Favored Pre-proline 0 CA--C 1.539 0.55 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 178.17 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -72.08 113.39 3.67 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 123.806 3.004 . . . . 0.0 109.669 172.286 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -91.89 34.54 1.0 Allowed 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.95 1.7 . . . . 0.0 111.99 -173.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.534 ' HB1' ' HD2' ' A' ' 72' ' ' PRO . . . 64.89 166.27 0.12 Allowed Pre-proline 0 CA--C 1.547 0.849 0 C-N-CA 126.684 1.994 . . . . 0.0 111.759 -175.258 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.534 ' HD2' ' HB1' ' A' ' 71' ' ' ALA . 62.0 Cg_endo -67.03 -177.8 1.13 Allowed 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 121.931 1.754 . . . . 0.0 112.626 178.425 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.2 tt -132.61 143.88 50.62 Favored Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 126.053 1.741 . . . . 0.0 108.745 -175.084 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -80.83 164.4 20.41 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 123.005 2.47 . . . . 0.0 111.968 -176.062 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -61.44 -10.87 17.41 Favored 'Trans proline' 0 CA--C 1.528 0.224 0 C-N-CA 123.013 2.475 . . . . 0.0 115.441 178.436 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -106.34 -15.59 14.79 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.043 1.737 . . . . 0.0 113.505 175.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.59 -37.99 95.59 Favored Glycine 0 CA--C 1.529 0.93 0 CA-C-N 119.051 0.841 . . . . 0.0 111.301 -177.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.3 tp -52.74 -47.74 67.18 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 125.291 1.436 . . . . 0.0 108.384 177.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -75.64 -17.34 60.02 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 127.625 2.37 . . . . 0.0 110.527 -170.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -84.31 -42.39 15.86 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.043 1.337 . . . . 0.0 110.502 170.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.5 mp -58.99 -52.74 64.46 Favored 'General case' 0 N--CA 1.46 0.073 0 C-N-CA 123.196 0.598 . . . . 0.0 109.895 176.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.757 HD13 HD13 ' A' ' 25' ' ' LEU . 4.1 mm -62.1 -33.51 58.84 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.148 0 C-N-CA 123.675 0.79 . . . . 0.0 110.653 178.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.86 -42.36 58.8 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 121.455 -0.778 . . . . 0.0 110.923 171.302 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.605 ' HB1' ' HB3' ' A' ' 23' ' ' ASN . . . -65.75 -42.64 90.68 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 118.997 -0.525 . . . . 0.0 112.3 -177.942 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.571 ' CB ' HD12 ' A' ' 25' ' ' LEU . 7.8 t60 -60.14 -53.44 57.77 Favored 'General case' 0 C--O 1.222 -0.346 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 172.547 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 94.8 m -57.03 -42.24 80.07 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 121.361 -0.837 . . . . 0.0 110.201 -174.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.42 -22.26 66.78 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-O 116.832 -1.556 . . . . 0.0 114.239 -178.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.444 HG23 ' CD2' ' A' ' 89' ' ' LEU 0.377 11.8 t -93.57 -13.39 27.77 Favored 'General case' 0 C--N 1.345 0.403 0 CA-C-N 121.3 1.863 . . . . 0.0 110.925 -177.06 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.444 ' CD2' HG23 ' A' ' 88' ' ' THR . 1.0 OUTLIER -107.85 -14.61 14.74 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 126.322 1.849 . . . . 0.0 111.625 -179.248 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 77.87 15.21 81.49 Favored Glycine 0 CA--C 1.53 0.988 0 CA-C-O 118.416 -1.214 . . . . 0.0 113.27 -172.568 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 24.8 m80 -75.76 160.56 29.88 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 119.163 1.482 . . . . 0.0 109.57 -178.003 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 59.7 m -109.26 163.38 13.42 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 123.515 0.726 . . . . 0.0 109.855 177.332 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 34.7 m -55.88 164.27 1.22 Allowed 'General case' 0 C--O 1.237 0.442 0 C-N-CA 124.313 1.045 . . . . 0.0 110.138 160.085 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 66.2 p -119.88 -163.02 0.96 Allowed 'General case' 0 C--O 1.239 0.53 0 C-N-CA 126.847 2.059 . . . . 0.0 106.902 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.38 169.6 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.19 0.996 . . . . 0.0 111.903 171.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.456 ' HE2' ' HB2' ' A' ' 100' ' ' HIS 0.285 0.0 OUTLIER 53.29 -170.71 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.4 1.48 . . . . 0.0 112.503 -176.938 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.09 77.3 4.6 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 178.188 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 4.6 t-160 67.01 -75.17 0.06 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.502 1.521 . . . . 0.0 109.749 -177.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 93.3 mt -141.63 153.56 44.83 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 121.851 2.114 . . . . 0.0 110.639 174.177 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' HIS . . . . . 0.456 ' HB2' ' HE2' ' A' ' 96' ' ' LYS . 23.9 t-80 -75.37 -39.25 59.45 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.716 175.402 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -175.05 178.28 1.79 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 122.948 0.499 . . . . 0.0 111.464 -167.601 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 58.4 t -64.45 -39.47 85.68 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 123.653 0.781 . . . . 0.0 109.892 -176.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 3.5 tpt -56.92 -32.1 65.6 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.795 -0.566 . . . . 0.0 111.796 177.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -72.2 -48.74 40.8 Favored 'General case' 0 C--O 1.226 -0.176 0 C-N-CA 124.429 1.091 . . . . 0.0 108.221 176.533 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.06 -50.08 67.54 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 125.224 1.41 . . . . 0.0 112.542 -178.362 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 37.6 mm -57.17 -45.81 84.58 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -178.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -74.03 -24.73 59.59 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.279 1.032 . . . . 0.0 112.733 -175.532 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -67.26 -70.46 0.25 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.993 0.917 . . . . 0.0 109.088 168.33 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 9.4 mp -51.39 -51.19 56.81 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 127.02 2.128 . . . . 0.0 113.298 -177.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -64.23 -12.6 42.39 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 118.186 -0.911 . . . . 0.0 112.28 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -100.85 -7.25 23.74 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 120.105 1.32 . . . . 0.0 112.303 175.052 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 95.8 mt -90.37 -47.71 7.57 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.79 1.236 . . . . 0.0 110.194 173.619 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -74.18 149.72 40.78 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 122.899 0.48 . . . . 0.0 110.626 -173.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.284 0 N-CA-C 106.913 -2.475 . . . . 0.0 106.913 -169.162 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.657 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 125.11 133.94 4.07 Favored Glycine 0 C--N 1.334 0.447 0 C-N-CA 126.089 1.804 . . . . 0.0 109.341 176.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -98.13 -160.21 0.79 Allowed 'General case' 0 C--O 1.238 0.478 0 C-N-CA 124.862 1.265 . . . . 0.0 110.351 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 141.52 -66.68 0.49 Allowed Glycine 0 C--N 1.338 0.645 0 O-C-N 121.402 -0.811 . . . . 0.0 114.2 171.076 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.0 mp0 -129.45 10.77 5.74 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.034 1.334 . . . . 0.0 112.501 -164.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -144.43 161.45 44.19 Favored Pre-proline 0 C--N 1.325 -0.475 0 C-N-CA 126.903 2.081 . . . . 0.0 109.159 -173.099 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -69.16 -55.33 0.2 Allowed 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 121.009 1.139 . . . . 0.0 110.555 -167.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' HIS . . . . . 0.409 ' CD2' ' HD2' ' A' ' 9' ' ' PRO . 5.4 t-80 -144.5 148.36 40.0 Favored Pre-proline 0 N--CA 1.451 -0.407 0 C-N-CA 126.614 1.965 . . . . 0.0 106.409 172.726 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.409 ' HD2' ' CD2' ' A' ' 8' ' ' HIS . 51.9 Cg_endo -72.96 -28.98 12.53 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 CA-C-N 120.919 1.364 . . . . 0.0 112.658 179.409 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -80.63 -10.02 59.76 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 118.726 -0.654 . . . . 0.0 112.06 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.5 tt -58.76 132.65 54.54 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 119.084 0.856 . . . . 0.0 109.851 168.411 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.6 mm -113.77 113.01 42.67 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 175.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 76.6 m95 -57.8 150.11 49.9 Favored Pre-proline 0 C--O 1.241 0.637 0 C-N-CA 123.255 0.622 . . . . 0.0 111.346 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -71.72 173.22 52.2 Favored 'Cis proline' 0 CA--C 1.54 0.785 0 N-CA-C 114.768 1.026 . . . . 0.0 114.768 0.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -131.17 167.47 19.1 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 124.29 1.036 . . . . 0.0 111.818 176.294 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.402 ' HA ' HD23 ' A' ' 16' ' ' LEU . 27.1 mt -139.54 105.09 5.09 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 126.851 2.061 . . . . 0.0 110.031 -175.269 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.476 HD23 ' CZ3' ' A' ' 34' ' ' TRP . 0.2 OUTLIER -81.56 165.01 21.52 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 123.602 0.761 . . . . 0.0 109.592 168.534 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.451 ' H ' HD13 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -156.64 88.04 1.04 Allowed 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 119.445 -0.312 . . . . 0.0 110.445 163.248 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 22.5 mt-30 -51.6 135.6 28.12 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -166.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -68.26 116.73 9.19 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 -176.68 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 105.3 -2.79 40.19 Favored Glycine 0 CA--C 1.525 0.704 0 CA-C-O 117.398 -1.779 . . . . 0.0 113.615 -173.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.83 172.75 7.94 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 119.956 1.878 . . . . 0.0 109.929 165.677 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.417 ' HB3' ' HB1' ' A' ' 84' ' ' ALA . 8.3 m-80 -110.95 -17.62 13.26 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 125.501 1.52 . . . . 0.0 108.881 177.068 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -76.24 127.98 34.0 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 -177.678 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.42 HD23 ' HB2' ' A' ' 18' ' ' LYS . 1.3 mt -82.53 159.51 22.81 Favored 'General case' 0 C--O 1.231 0.1 0 C-N-CA 123.48 0.712 . . . . 0.0 109.539 170.445 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -122.6 88.95 49.79 Favored Pre-proline 0 C--N 1.328 -0.33 0 C-N-CA 125.665 1.586 . . . . 0.0 110.71 -173.475 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -62.09 126.3 18.39 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 123.777 2.985 . . . . 0.0 109.961 179.172 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -115.28 100.37 8.08 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 107.154 -1.425 . . . . 0.0 107.154 169.577 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 67.5 mtt-85 -52.64 -53.16 50.81 Favored 'General case' 0 N--CA 1.463 0.196 0 C-N-CA 124.584 1.154 . . . . 0.0 110.59 175.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.0 t -144.23 -177.75 5.62 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 122.313 1.054 . . . . 0.0 109.828 178.297 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -50.92 -39.1 53.78 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 126.571 1.948 . . . . 0.0 110.841 178.142 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -43.03 98.23 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.393 0.677 . . . . 0.0 111.222 178.185 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -68.2 -26.82 65.92 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 124.33 1.052 . . . . 0.0 110.773 -177.467 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.476 ' CZ3' HD23 ' A' ' 17' ' ' LEU . 60.8 t-105 -79.25 -41.18 28.79 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 123.663 0.785 . . . . 0.0 111.81 170.687 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -58.04 -45.66 86.63 Favored 'General case' 0 N--CA 1.462 0.132 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 178.167 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -46.17 -46.43 17.37 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 125.209 1.404 . . . . 0.0 112.363 173.371 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 11.4 t80 -55.64 -54.62 41.99 Favored 'General case' 0 N--CA 1.453 -0.322 0 O-C-N 123.574 0.546 . . . . 0.0 110.293 -174.311 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 43.9 t -75.63 -27.85 58.58 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.278 1.031 . . . . 0.0 111.136 -179.439 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.72 -24.92 67.97 Favored 'General case' 0 N--CA 1.457 -0.12 0 C-N-CA 123.809 0.844 . . . . 0.0 110.422 175.492 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -82.21 68.15 8.5 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 122.902 1.334 . . . . 0.0 110.557 -178.539 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 17.4 t 54.83 32.11 17.0 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 125.812 1.645 . . . . 0.0 114.407 178.253 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 40.5 mtmt 44.63 58.19 4.04 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 123.865 0.866 . . . . 0.0 108.812 -168.331 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 47.3 t-80 -44.46 152.32 0.21 Allowed 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 157.125 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -44.63 121.98 2.92 Favored 'General case' 0 N--CA 1.439 -1.009 0 C-N-CA 127.161 2.185 . . . . 0.0 113.01 -163.471 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 49.0 mt -138.43 111.41 7.81 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 105.157 -2.164 . . . . 0.0 105.157 169.475 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -121.1 164.44 16.82 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 123.584 0.754 . . . . 0.0 109.81 -178.039 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.428 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 13.3 m-85 -60.34 138.64 57.93 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 176.668 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 84.2 9.12 82.67 Favored Glycine 0 CA--C 1.524 0.614 0 CA-C-O 119.106 -0.83 . . . . 0.0 113.496 174.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.404 ' HB3' HD11 ' A' ' 17' ' ' LEU . 2.2 m-20 -65.46 -25.88 67.7 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 119.41 1.605 . . . . 0.0 112.485 -171.637 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 19.9 ttmt 75.12 145.5 0.08 Allowed 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 129.523 3.129 . . . . 0.0 112.421 175.046 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 9.4 tp -135.57 157.86 45.82 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 107.521 -1.288 . . . . 0.0 107.521 171.005 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 24.2 t -134.45 141.89 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.74 0 C-N-CA 127.456 2.302 . . . . 0.0 106.27 167.565 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -104.11 176.65 5.08 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.897 1.279 . . . . 0.0 112.067 167.235 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -69.54 -5.41 24.08 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 -179.581 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 36.3 m120 -89.87 -1.27 57.95 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 119.412 1.005 . . . . 0.0 111.252 170.016 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 70.13 18.97 6.88 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 127.08 2.152 . . . . 0.0 110.959 -171.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 23.4 m170 -66.88 117.24 8.71 Favored 'General case' 0 C--N 1.34 0.164 0 O-C-N 120.801 -1.187 . . . . 0.0 108.891 169.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 72.6 m -83.11 156.32 23.35 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 118.997 0.817 . . . . 0.0 110.11 169.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -144.71 158.45 43.78 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 125.968 1.707 . . . . 0.0 109.313 177.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 24.4 t -115.86 162.73 13.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 C-N-CA 127.885 2.474 . . . . 0.0 106.907 169.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.52 HD12 ' O ' ' A' ' 66' ' ' HIS . 29.2 tp -111.82 133.45 54.02 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 166.328 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 62.1 mp0 -113.58 -172.8 2.14 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.742 2.017 . . . . 0.0 109.807 -171.02 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.428 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 2.5 mp0 -77.06 -18.31 58.15 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 120.734 -1.229 . . . . 0.0 113.3 178.777 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -75.25 -7.98 55.36 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 127.502 2.321 . . . . 0.0 113.444 -168.302 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 64.34 17.1 10.57 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 129.158 2.983 . . . . 0.0 114.376 -161.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.52 ' O ' HD12 ' A' ' 61' ' ' LEU . 1.1 p-80 -93.94 162.4 13.91 Favored 'General case' 0 C--N 1.34 0.195 0 C-N-CA 125.881 1.672 . . . . 0.0 114.336 164.746 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.415 ' NE1' HD13 ' A' ' 61' ' ' LEU . 62.0 m95 -106.58 106.41 16.92 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 106.644 -1.613 . . . . 0.0 106.644 164.143 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.406 ' CG ' ' HD2' ' A' ' 69' ' ' PRO . 0.1 OUTLIER -87.13 156.37 54.62 Favored Pre-proline 0 CA--C 1.545 0.773 0 C-N-CA 123.484 0.713 . . . . 0.0 109.104 175.083 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.406 ' HD2' ' CG ' ' A' ' 68' ' ' HIS . 66.9 Cg_endo -79.78 156.21 24.03 Favored 'Trans proline' 0 N--CA 1.455 -0.759 0 C-N-CA 122.303 2.002 . . . . 0.0 111.989 -172.151 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -132.25 31.91 4.04 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.056 1.342 . . . . 0.0 110.991 -177.519 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 71.72 165.42 0.13 Allowed Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 128.115 2.566 . . . . 0.0 111.802 179.219 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -71.43 -179.18 3.43 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 121.677 1.585 . . . . 0.0 109.927 169.226 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 12.8 tp -133.68 150.89 76.02 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-O 118.56 -0.733 . . . . 0.0 111.699 -174.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -61.97 159.47 33.81 Favored 'Trans proline' 0 CA--C 1.536 0.589 0 C-N-CA 122.178 1.919 . . . . 0.0 111.173 166.207 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -67.88 -38.06 14.17 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 122.329 2.019 . . . . 0.0 111.245 -178.04 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -72.86 -11.02 60.43 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 124.162 0.985 . . . . 0.0 110.569 175.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -68.78 -28.5 73.05 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-O 118.934 -0.926 . . . . 0.0 111.416 171.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 46.5 tp -62.88 -54.15 43.18 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 118.523 1.161 . . . . 0.0 108.728 170.473 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -50.24 -43.92 53.17 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.588 1.155 . . . . 0.0 111.661 177.36 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -60.78 -36.82 79.94 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 126.099 1.76 . . . . 0.0 112.724 177.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.423 HD13 ' HA ' ' A' ' 81' ' ' LEU . 1.2 mm? -72.22 -54.4 9.72 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 119.181 0.9 . . . . 0.0 109.84 172.81 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.406 ' HA ' ' CD1' ' A' ' 25' ' ' LEU . 4.4 mm -50.01 -37.82 13.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 126.372 1.869 . . . . 0.0 110.553 -177.709 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.01 -40.62 6.66 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 125.687 1.595 . . . . 0.0 112.661 176.3 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.417 ' HB1' ' HB3' ' A' ' 23' ' ' ASN . . . -60.34 -58.36 8.86 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 119.573 1.078 . . . . 0.0 111.581 178.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -58.82 -45.48 89.88 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 124.166 0.986 . . . . 0.0 109.383 -179.429 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 96.0 m -73.32 -17.18 61.33 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 120.641 -1.287 . . . . 0.0 112.774 -176.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -84.47 -20.62 31.42 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 119.396 0.998 . . . . 0.0 112.17 173.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.4 t -100.87 -17.35 16.89 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.37 0.532 . . . . 0.0 111.009 -178.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 52.2 mt -102.18 2.83 37.74 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.973 1.309 . . . . 0.0 111.166 165.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 66.59 15.4 64.0 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 125.187 1.375 . . . . 0.0 115.692 171.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 37.4 m-70 -80.08 -35.13 37.39 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 119.5 1.65 . . . . 0.0 112.648 -174.14 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 68.0 m 47.54 -172.4 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 124.859 1.264 . . . . 0.0 113.479 -166.515 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 7.4 p -97.62 160.41 14.33 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 124.641 1.176 . . . . 0.0 111.4 -177.482 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 4.3 t 174.97 161.54 0.22 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 129.203 3.001 . . . . 0.0 105.703 -179.298 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 63.92 109.96 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.382 1.873 . . . . 0.0 112.454 171.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.6 ttpm? 55.41 52.78 10.78 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.352 1.061 . . . . 0.0 111.03 171.454 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 8.6 ttp 48.37 43.6 19.53 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.474 1.91 . . . . 0.0 112.564 -174.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 74.91 -58.53 0.57 Allowed 'General case' 0 C--N 1.34 0.195 0 C-N-CA 125.752 1.621 . . . . 0.0 111.176 -170.78 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 91.4 mt -155.08 121.87 5.42 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 126.259 1.824 . . . . 0.0 107.351 -155.555 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 32.1 t-80 -67.88 -37.1 81.36 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 117.889 0.313 . . . . 0.0 111.371 171.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 4.7 t -158.92 176.12 12.71 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.781 0.832 . . . . 0.0 111.477 -171.675 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 79.0 t -55.77 -36.9 44.85 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 C-N-CA 124.19 0.996 . . . . 0.0 108.988 167.392 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 26.0 tpp -60.01 -39.6 86.37 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.611 0.764 . . . . 0.0 112.311 178.237 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -61.28 -52.77 63.35 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 176.037 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.77 -41.7 70.82 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 125.005 1.322 . . . . 0.0 112.338 -171.458 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 22.4 mm -56.73 -46.89 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.266 0 CA-C-N 120.03 1.286 . . . . 0.0 111.127 -177.693 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -79.83 -36.89 36.18 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 118.164 0.438 . . . . 0.0 110.194 -178.27 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -59.77 -51.6 69.06 Favored 'General case' 0 C--N 1.337 0.056 0 C-N-CA 125.09 1.356 . . . . 0.0 110.978 -178.659 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 95.8 mt -68.06 -31.27 70.79 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 125.083 1.353 . . . . 0.0 110.902 -177.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -65.99 -40.15 90.93 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-O 118.894 -0.574 . . . . 0.0 110.8 175.693 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -75.07 0.68 15.25 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.583 1.153 . . . . 0.0 113.071 -179.533 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 45.4 mt -80.39 -28.09 38.0 Favored 'General case' 0 N--CA 1.457 -0.109 0 CA-C-N 118.95 0.795 . . . . 0.0 110.488 166.766 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -81.6 164.91 21.55 Favored 'General case' 0 C--O 1.24 0.563 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 166.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.163 0 N-CA-C 106.8 -2.52 . . . . 0.0 106.8 -164.05 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.4 mtp . . . . . 0 N--CA 1.477 0.908 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 128.51 -57.77 0.71 Allowed Glycine 0 CA--C 1.522 0.495 0 N-CA-C 109.243 -1.543 . . . . 0.0 109.243 -176.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 48.53 -154.64 0.09 Allowed 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.199 1.4 . . . . 0.0 111.709 -176.208 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 91.47 -117.46 5.21 Favored Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 106.81 -2.516 . . . . 0.0 106.81 -162.263 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -96.64 10.87 37.29 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.771 1.628 . . . . 0.0 112.895 -161.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.7 p -83.99 160.1 58.61 Favored Pre-proline 0 CA--C 1.537 0.479 0 C-N-CA 125.145 1.378 . . . . 0.0 110.546 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -67.88 -55.0 0.29 Allowed 'Trans proline' 0 N--CA 1.459 -0.5 0 C-N-CA 122.467 2.111 . . . . 0.0 111.267 -169.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -135.75 144.29 48.23 Favored Pre-proline 0 C--O 1.238 0.482 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 176.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -77.4 -17.75 14.43 Favored 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 122.394 2.063 . . . . 0.0 111.965 -176.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -81.43 -26.43 35.36 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 117.636 -1.174 . . . . 0.0 111.964 173.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 tt -56.68 133.34 53.85 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.295 0.952 . . . . 0.0 109.823 -171.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 46.7 mm -112.71 116.37 52.4 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.123 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 -175.051 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 76.5 m95 -60.52 154.35 55.71 Favored Pre-proline 0 N--CA 1.45 -0.444 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.64 176.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -72.15 162.94 88.84 Favored 'Cis proline' 0 N--CA 1.458 -0.597 0 C-N-CA 124.853 -0.895 . . . . 0.0 112.684 -3.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -131.96 166.53 21.48 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 121.773 0.797 . . . . 0.0 110.966 179.237 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 38.6 mt -138.26 106.5 5.77 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 124.917 1.287 . . . . 0.0 108.813 -170.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.2 tp -84.67 148.79 26.23 Favored 'General case' 0 C--O 1.236 0.395 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 171.023 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -142.54 96.67 2.98 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 119.612 1.097 . . . . 0.0 108.592 167.135 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -55.15 151.57 9.14 Favored 'General case' 0 C--O 1.24 0.575 0 O-C-N 124.628 1.205 . . . . 0.0 112.425 -164.495 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -71.02 88.56 0.77 Allowed 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.512 0.672 . . . . 0.0 110.967 -177.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 137.15 -34.3 2.21 Favored Glycine 0 CA--C 1.524 0.633 0 C-N-CA 126.251 1.881 . . . . 0.0 110.618 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 85.3 m -76.86 177.07 7.96 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 122.89 1.329 . . . . 0.0 111.257 -178.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -128.82 -35.25 1.89 Allowed 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 126.712 2.005 . . . . 0.0 109.216 -175.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -59.69 131.71 51.76 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.231 1.412 . . . . 0.0 107.856 169.206 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.424 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -84.17 150.73 25.31 Favored 'General case' 0 CA--C 1.515 -0.393 0 C-N-CA 124.351 1.061 . . . . 0.0 108.678 164.232 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.424 HD22 ' HA ' ' A' ' 26' ' ' LEU . 0.2 OUTLIER -103.68 88.64 1.89 Allowed Pre-proline 0 C--N 1.327 -0.403 0 C-N-CA 128.294 2.637 . . . . 0.0 107.549 176.277 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -56.89 127.13 24.59 Favored 'Trans proline' 0 N--CA 1.45 -1.037 0 N-CA-C 108.988 -1.197 . . . . 0.0 108.988 169.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -118.22 103.54 9.94 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 106.089 -1.819 . . . . 0.0 106.089 166.456 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 67.8 mtt85 -56.74 -42.51 79.41 Favored 'General case' 0 CA--C 1.519 -0.213 0 O-C-N 122.279 -0.263 . . . . 0.0 110.562 174.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.429 HG23 ' H ' ' A' ' 32' ' ' ASP . 5.0 t -157.49 -177.47 6.62 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 118.344 0.52 . . . . 0.0 110.782 -177.834 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -51.95 -42.37 62.8 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 125.411 1.485 . . . . 0.0 110.695 174.256 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.429 ' H ' HG23 ' A' ' 30' ' ' THR . 22.0 t70 -54.44 -50.77 66.87 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-N 118.713 0.688 . . . . 0.0 110.639 175.627 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -57.2 -45.6 83.64 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.217 1.407 . . . . 0.0 110.368 178.018 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 39.6 t-105 -58.3 -40.93 83.31 Favored 'General case' 0 C--N 1.34 0.18 0 C-N-CA 123.8 0.84 . . . . 0.0 111.274 176.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -58.91 -45.25 90.76 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 178.472 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 8.4 mtt180 -62.6 -32.08 73.02 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 124.056 0.943 . . . . 0.0 111.531 -168.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -49.63 -61.19 2.25 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 125.052 1.341 . . . . 0.0 109.745 171.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 34.6 t -69.23 -35.84 76.59 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -175.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.6 -24.07 67.65 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.782 0.833 . . . . 0.0 110.938 -177.751 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -78.48 6.01 9.48 Favored 'General case' 0 C--N 1.342 0.267 0 N-CA-C 113.507 0.929 . . . . 0.0 113.507 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 71.13 8.12 6.35 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.823 1.249 . . . . 0.0 111.355 -170.644 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 49.8 mmtt -94.73 38.24 1.12 Allowed 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 125.623 1.569 . . . . 0.0 110.35 -177.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -74.99 32.03 0.1 Allowed 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 114.31 1.226 . . . . 0.0 114.31 -175.408 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.61 103.54 1.1 Allowed 'General case' 0 N--CA 1.443 -0.807 0 C-N-CA 125.897 1.679 . . . . 0.0 108.593 -177.238 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 72.3 mt -126.73 147.8 49.94 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 -175.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -158.91 131.14 6.7 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 104.652 -2.351 . . . . 0.0 104.652 -167.422 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.717 ' HA ' HD13 ' A' ' 61' ' ' LEU . 52.8 m-85 -60.07 144.08 50.46 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 -176.67 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.11 8.28 66.94 Favored Glycine 0 N--CA 1.443 -0.848 0 CA-C-O 118.292 -1.282 . . . . 0.0 114.812 -179.597 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.47 -9.76 14.31 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.542 1.937 . . . . 0.0 115.207 -174.029 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 15.8 ttmt 51.09 135.55 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.08 1 C-N-CA 132.025 4.13 . . . . 0.0 115.66 174.771 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 11.5 mt -129.38 157.57 41.58 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 121.088 -1.007 . . . . 0.0 109.568 174.523 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 37.4 t -135.26 141.35 42.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 127.476 2.31 . . . . 0.0 106.026 173.652 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -118.1 179.63 4.04 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.803 1.641 . . . . 0.0 111.781 172.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 98.5 p -61.12 -27.3 68.28 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.876 1.271 . . . . 0.0 113.653 -175.359 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -82.73 1.22 39.84 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 125.64 1.576 . . . . 0.0 110.745 178.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 61.3 23.73 13.92 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.542 1.537 . . . . 0.0 110.405 -170.142 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 27.8 m170 -61.08 124.04 19.39 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 120.699 1.59 . . . . 0.0 107.515 164.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.498 ' HB3' ' HB3' ' A' ' 70' ' ' ALA . 0.7 OUTLIER -88.5 145.85 25.51 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 107.138 -1.431 . . . . 0.0 107.138 166.785 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -135.99 155.69 49.87 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.192 0.997 . . . . 0.0 109.028 174.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 40.0 t -141.62 131.63 25.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 C-N-CA 128.046 2.538 . . . . 0.0 107.074 -177.693 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.717 HD13 ' HA ' ' A' ' 47' ' ' TYR . 0.2 OUTLIER -74.55 123.33 24.6 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 107.159 -1.422 . . . . 0.0 107.159 169.436 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -110.54 167.31 10.31 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.225 0.921 . . . . 0.0 109.438 173.559 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -59.54 -4.16 0.58 Allowed 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.848 1.259 . . . . 0.0 113.643 178.294 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -77.87 -2.73 38.11 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 120.606 -1.309 . . . . 0.0 111.755 167.525 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 70.68 -3.0 2.06 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 126.613 1.965 . . . . 0.0 112.286 -178.274 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -89.1 166.17 14.03 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 123.604 0.762 . . . . 0.0 110.737 175.508 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 68.5 m95 -107.35 97.41 7.17 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 125.616 1.567 . . . . 0.0 107.012 173.61 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 54.9 t-80 -79.81 145.09 61.28 Favored Pre-proline 0 CA--C 1.543 0.705 0 CA-C-O 118.122 -0.942 . . . . 0.0 110.222 -175.244 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -68.47 109.0 1.94 Allowed 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 124.166 3.244 . . . . 0.0 112.5 172.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.498 ' HB3' ' HB3' ' A' ' 58' ' ' CYS . . . -80.0 21.05 0.59 Allowed 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.287 1.435 . . . . 0.0 111.858 170.936 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 67.17 165.85 0.12 Allowed Pre-proline 0 C--O 1.237 0.434 0 C-N-CA 127.3 2.24 . . . . 0.0 111.817 -176.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -65.05 163.9 26.99 Favored 'Trans proline' 0 N--CA 1.447 -1.23 0 C-N-CA 120.81 1.007 . . . . 0.0 112.39 174.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 15.8 tp -118.95 146.75 40.95 Favored Pre-proline 0 CA--C 1.535 0.39 0 C-N-CA 126.279 1.832 . . . . 0.0 110.102 -173.737 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.49 164.35 31.23 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 122.278 1.985 . . . . 0.0 111.523 173.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -59.02 -33.54 98.77 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.843 2.362 . . . . 0.0 112.353 178.369 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -77.58 -24.71 49.7 Favored 'General case' 0 N--CA 1.454 -0.239 0 O-C-N 121.697 -0.627 . . . . 0.0 111.239 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -64.43 -29.13 74.25 Favored Glycine 0 CA--C 1.532 1.127 0 CA-C-N 118.4 0.545 . . . . 0.0 112.396 -174.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 37.5 tp -55.73 -53.0 61.98 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 124.871 1.268 . . . . 0.0 109.638 169.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -64.25 -25.78 68.21 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.255 0.622 . . . . 0.0 111.3 -173.51 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -72.26 -20.41 61.53 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.761 0.824 . . . . 0.0 112.521 177.186 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 67.1 mt -83.17 -50.22 8.67 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 118.924 0.784 . . . . 0.0 109.026 168.512 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.8 mm -50.87 -40.28 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 126.094 1.758 . . . . 0.0 111.655 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.82 -41.81 7.33 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 125.104 1.362 . . . . 0.0 110.751 176.728 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -73.78 -44.77 55.02 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -178.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.424 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 5.6 t60 -62.87 -45.06 94.32 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 119.682 1.128 . . . . 0.0 108.843 177.526 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 91.9 m -62.69 -41.05 98.92 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.484 177.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.69 -33.31 73.74 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -178.374 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 9.2 t -74.4 -38.89 62.98 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.971 0.805 . . . . 0.0 109.042 -177.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 78.4 mt -87.41 -52.11 5.55 Favored 'General case' 0 N--CA 1.462 0.166 0 O-C-N 121.659 -0.651 . . . . 0.0 109.772 -173.497 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 115.98 58.06 0.33 Allowed Glycine 0 CA--C 1.523 0.535 0 C-N-CA 125.971 1.748 . . . . 0.0 108.918 -179.314 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' HIS . . . . . 0.553 ' ND1' HD13 ' A' ' 112' ' ' LEU . 47.4 m170 -115.32 164.61 14.0 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 123.777 0.831 . . . . 0.0 110.895 -175.65 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 64.2 m -114.51 -164.9 0.97 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.795 1.238 . . . . 0.0 111.106 -170.648 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 1.2 p -129.42 103.54 6.97 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 125.068 1.347 . . . . 0.0 109.348 -163.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 8.3 t -80.8 74.34 7.76 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 127.006 2.122 . . . . 0.0 109.257 -175.756 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 27.1 t 64.89 172.38 0.2 Allowed 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.303 1.441 . . . . 0.0 111.508 -177.389 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 2.4 mptp? 48.49 -164.31 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.524 1.13 . . . . 0.0 109.691 -158.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 7.4 mtm -68.21 -16.52 64.01 Favored 'General case' 0 N--CA 1.463 0.214 0 O-C-N 120.999 -1.063 . . . . 0.0 112.817 177.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -168.43 -50.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 126.94 2.096 . . . . 0.0 110.463 -178.625 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.418 HD13 ' HB2' ' A' ' 105' ' ' ALA . 89.7 mt -154.3 163.38 40.23 Favored 'General case' 0 CA--C 1.514 -0.433 0 C-N-CA 127.119 2.168 . . . . 0.0 109.88 -170.427 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -86.56 -37.39 18.2 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 123.692 0.797 . . . . 0.0 112.644 169.063 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 4.5 t -172.41 -178.92 2.11 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 118.582 0.628 . . . . 0.0 112.684 -165.629 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 45.2 t -68.05 -39.82 82.11 Favored 'Isoleucine or valine' 0 C--N 1.345 0.371 0 C-N-CA 124.048 0.939 . . . . 0.0 111.194 -179.066 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -59.89 -44.89 93.98 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 177.599 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.55 -49.71 67.09 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 127.388 2.275 . . . . 0.0 109.968 174.71 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.418 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -59.21 -56.29 24.0 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 124.924 1.29 . . . . 0.0 111.28 179.357 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 3.4 mm -60.17 -41.07 85.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -174.106 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -59.98 -50.05 75.27 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 124.032 0.933 . . . . 0.0 110.25 176.259 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.704 ' CE2' HD11 ' A' ' 112' ' ' LEU . 48.4 t80 -54.5 -67.46 0.26 Allowed 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 126.666 1.986 . . . . 0.0 110.022 178.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.54 ' HA ' HD12 ' A' ' 112' ' ' LEU . 6.9 mp -47.48 -49.95 24.44 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 125.266 1.426 . . . . 0.0 111.681 179.869 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 63.3 m-80 -79.44 -4.79 52.77 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -176.372 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -99.15 -25.59 14.48 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 119.559 1.072 . . . . 0.0 111.169 169.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.704 HD11 ' CE2' ' A' ' 108' ' ' PHE . 40.3 mt -62.8 -60.28 3.71 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 174.514 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -72.54 154.11 40.98 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 123.96 0.788 . . . . 0.0 111.349 -169.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.106 0 N-CA-C 106.864 -2.494 . . . . 0.0 106.864 -176.72 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.4 ptp . . . . . 0 N--CA 1.473 0.694 0 CA-C-O 119.78 -0.152 . . . . 0.0 110.814 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 64.96 -172.0 21.62 Favored Glycine 0 CA--C 1.537 1.46 0 O-C-N 121.786 -0.571 . . . . 0.0 113.403 176.307 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -50.73 129.34 22.71 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 126.815 2.046 . . . . 0.0 111.568 -171.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 137.89 -72.06 0.45 Allowed Glycine 0 CA--C 1.519 0.289 0 N-CA-C 108.742 -1.743 . . . . 0.0 108.742 -164.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -84.5 9.72 12.76 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 27.2 p -122.86 151.01 60.21 Favored Pre-proline 0 C--O 1.238 0.457 0 C-N-CA 124.065 0.946 . . . . 0.0 111.717 -176.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -74.53 95.66 0.95 Allowed 'Trans proline' 0 N--CA 1.45 -1.08 0 C-N-CA 123.244 2.63 . . . . 0.0 109.487 178.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 75.6 144.51 0.1 Allowed Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 128.294 2.638 . . . . 0.0 113.964 176.138 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -80.03 -20.56 8.69 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 122.877 2.385 . . . . 0.0 114.201 -178.051 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -78.12 -18.59 55.46 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 117.295 -1.336 . . . . 0.0 111.527 172.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 tt -60.89 127.0 29.44 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 121.276 1.853 . . . . 0.0 110.831 -174.675 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 44.6 mm -111.73 118.59 57.96 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.096 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 178.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 63.7 m95 -64.53 152.85 88.47 Favored Pre-proline 0 C--O 1.237 0.411 0 CA-C-O 118.53 -0.748 . . . . 0.0 110.5 173.355 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -70.17 160.2 89.66 Favored 'Cis proline' 0 N--CA 1.458 -0.593 0 C-N-CA 124.697 -0.96 . . . . 0.0 113.717 -1.323 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -119.6 168.36 11.1 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.972 0.909 . . . . 0.0 109.687 174.028 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 16.0 mt -140.25 91.25 2.43 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.885 2.074 . . . . 0.0 107.1 -179.263 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 26.8 tp -68.34 144.86 54.64 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 106.234 -1.765 . . . . 0.0 106.234 160.439 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -143.11 95.64 2.8 Favored 'General case' 0 CA--C 1.506 -0.743 0 N-CA-C 103.776 -2.675 . . . . 0.0 103.776 167.204 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.482 HE22 ' HB3' ' A' ' 44' ' ' LEU . 8.1 mt-30 -55.06 137.43 46.47 Favored 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 124.717 1.261 . . . . 0.0 109.861 -167.637 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.8 134.33 56.59 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-O 122.449 1.119 . . . . 0.0 109.051 175.684 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 97.73 -45.69 1.7 Allowed Glycine 0 CA--C 1.526 0.741 0 C-N-CA 126.251 1.881 . . . . 0.0 111.446 -172.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 66.3 m -68.44 165.59 18.57 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 118.216 1.008 . . . . 0.0 109.983 174.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.559 ' HB3' ' HB1' ' A' ' 84' ' ' ALA . 0.9 OUTLIER -116.48 -29.3 6.2 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.407 1.483 . . . . 0.0 108.267 173.931 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -64.98 144.98 56.93 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 127.426 2.29 . . . . 0.0 109.738 174.194 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.1 mt -99.98 161.43 13.61 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 125.885 1.674 . . . . 0.0 110.152 -176.289 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -115.05 85.96 13.0 Favored Pre-proline 0 C--O 1.236 0.345 0 C-N-CA 125.201 1.4 . . . . 0.0 108.622 164.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -65.88 135.22 40.33 Favored 'Trans proline' 0 N--CA 1.453 -0.905 0 C-N-CA 121.987 1.791 . . . . 0.0 108.502 168.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.5 mt -134.2 100.45 4.7 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 -177.121 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.6 mtt180 -58.92 -47.39 85.18 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.144 0.497 . . . . 0.0 111.175 -168.2 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 66.3 p -141.87 175.98 9.29 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -172.65 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -54.13 -36.48 63.32 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-O 119.132 -0.461 . . . . 0.0 110.446 166.647 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -67.38 -16.77 64.43 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -174.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -80.95 -43.93 18.99 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.345 1.058 . . . . 0.0 109.647 171.474 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 76.4 t-105 -64.89 -37.82 88.91 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.144 0.978 . . . . 0.0 111.877 176.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.9 mm100 -52.61 -48.47 66.31 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 124.666 1.187 . . . . 0.0 109.055 177.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 45.4 mtp85 -61.94 -31.69 72.04 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 124.839 1.256 . . . . 0.0 112.236 179.601 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -73.79 -54.22 8.52 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.262 0.625 . . . . 0.0 109.806 -178.495 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 23.8 t -65.57 -24.02 66.99 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.545 0.738 . . . . 0.0 112.276 176.363 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.93 -46.73 70.68 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.365 1.066 . . . . 0.0 109.985 172.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -114.66 73.3 0.82 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-O 122.252 1.025 . . . . 0.0 111.253 -157.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 36.8 m 70.97 107.5 0.06 Allowed 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 127.008 2.123 . . . . 0.0 110.383 177.134 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.3 -17.75 0.17 Allowed 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 127.51 2.324 . . . . 0.0 116.864 -173.325 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 73.92 -170.04 0.11 Allowed 'General case' 0 C--O 1.238 0.488 0 C-N-CA 125.379 1.472 . . . . 0.0 113.437 164.701 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.482 ' HB3' HE22 ' A' ' 19' ' ' GLN . 4.8 mt -70.29 123.62 22.15 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 106.838 -1.541 . . . . 0.0 106.838 174.327 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 93.5 mt -139.71 143.58 37.12 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 105.63 -1.989 . . . . 0.0 105.63 171.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 26.3 pt20 -157.6 130.33 7.45 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 104.628 -2.36 . . . . 0.0 104.628 -173.318 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -56.87 132.53 52.79 Favored 'General case' 0 C--O 1.243 0.733 0 N-CA-C 105.554 -2.017 . . . . 0.0 105.554 175.354 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 100.76 -0.25 55.29 Favored Glycine 0 CA--C 1.534 1.264 0 CA-C-O 118.989 -0.895 . . . . 0.0 115.239 -176.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.58 -19.87 28.59 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 119.874 1.837 . . . . 0.0 115.282 -174.214 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt 62.13 136.37 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 129.786 3.234 . . . . 0.0 113.718 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 8.4 tp -126.76 153.0 46.13 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 174.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 27.5 t -132.67 128.83 57.99 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 N-CA-C 103.783 -2.673 . . . . 0.0 103.783 172.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -97.23 177.76 5.46 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 122.06 0.933 . . . . 0.0 110.748 168.112 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.1 t -60.65 -19.88 59.37 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.162 1.385 . . . . 0.0 112.763 -178.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -84.32 -14.08 50.66 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 120.535 1.516 . . . . 0.0 113.084 -176.013 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 67.85 41.65 2.1 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 118.853 0.751 . . . . 0.0 109.72 -158.522 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 31.6 m170 -91.78 127.64 37.32 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 154.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -90.07 159.44 16.82 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 173.04 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -144.48 161.02 40.11 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 123.43 0.692 . . . . 0.0 110.539 177.301 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 25.7 t -139.07 131.05 36.33 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 128.096 2.558 . . . . 0.0 106.881 177.099 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.07 130.67 38.69 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 105.936 -1.875 . . . . 0.0 105.936 171.878 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -123.27 166.83 14.6 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.194 1.397 . . . . 0.0 109.692 177.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -57.74 -27.91 63.42 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 119.861 -1.774 . . . . 0.0 114.86 -166.591 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -75.39 15.11 0.49 Allowed 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 128.803 2.841 . . . . 0.0 112.369 177.003 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 68.7 9.23 7.22 Favored 'General case' 0 C--N 1.355 0.825 0 C-N-CA 125.61 1.564 . . . . 0.0 113.231 167.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 2.5 p80 -101.31 159.48 15.23 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 122.386 1.089 . . . . 0.0 111.396 172.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 82.2 m95 -97.49 97.75 9.35 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 105.867 -1.901 . . . . 0.0 105.867 168.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 80.2 t60 -71.28 143.77 88.63 Favored Pre-proline 0 CA--C 1.538 0.511 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 175.452 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -68.38 105.83 1.31 Allowed 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.314 2.676 . . . . 0.0 108.97 173.472 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.67 43.74 0.69 Allowed 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 126.03 1.732 . . . . 0.0 110.892 -176.029 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.531 ' HB1' ' HD2' ' A' ' 72' ' ' PRO . . . 60.73 166.47 0.09 OUTLIER Pre-proline 0 CA--C 1.542 0.637 0 C-N-CA 125.666 1.586 . . . . 0.0 111.942 -167.755 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.531 ' HD2' ' HB1' ' A' ' 71' ' ' ALA . 57.6 Cg_endo -64.13 177.42 1.99 Allowed 'Trans proline' 0 N--CA 1.451 -1.002 0 C-N-CA 121.122 1.215 . . . . 0.0 111.977 168.852 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 6.0 tt -122.61 143.46 39.96 Favored Pre-proline 0 CA--C 1.534 0.347 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -79.73 165.27 22.59 Favored 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 122.085 1.857 . . . . 0.0 110.662 -175.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -65.17 -15.63 51.17 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 121.689 1.593 . . . . 0.0 113.248 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -89.32 -27.36 20.57 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.965 0.906 . . . . 0.0 112.925 172.094 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.54 -36.43 89.36 Favored Glycine 0 C--N 1.344 1.003 0 C-N-CA 124.738 1.161 . . . . 0.0 112.404 -166.399 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.0 tp -57.61 -48.24 79.96 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 125.687 1.595 . . . . 0.0 108.445 -178.232 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -62.29 -25.77 68.04 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 118.137 -0.935 . . . . 0.0 112.574 -173.383 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -72.61 -37.05 68.19 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.486 1.039 . . . . 0.0 111.551 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.4 mp -65.27 -49.98 67.51 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.837 0.855 . . . . 0.0 110.321 173.143 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 15.4 mm -52.19 -42.59 36.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 125.228 1.411 . . . . 0.0 109.178 174.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.4 ttt-85 -52.66 -18.04 1.6 Allowed 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 126.919 2.088 . . . . 0.0 114.61 175.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.559 ' HB1' ' HB3' ' A' ' 23' ' ' ASN . . . -90.1 -51.68 5.34 Favored 'General case' 0 CA--C 1.527 0.079 0 CA-C-N 120.235 1.379 . . . . 0.0 110.859 176.501 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -57.59 -48.15 80.19 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 121.958 0.885 . . . . 0.0 110.317 175.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 90.3 m -66.86 -36.66 82.82 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 121.52 -0.737 . . . . 0.0 110.877 -177.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.53 -46.72 84.7 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 118.521 0.601 . . . . 0.0 111.176 175.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.5 t -68.55 -31.44 70.66 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -172.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 91.0 mt -79.87 -57.44 3.65 Favored 'General case' 0 N--CA 1.463 0.185 0 O-C-N 121.06 -1.025 . . . . 0.0 110.619 176.443 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 127.25 39.66 0.37 Allowed Glycine 0 CA--C 1.533 1.18 0 C-N-CA 125.756 1.646 . . . . 0.0 112.853 -177.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 65.8 m-70 -120.27 169.21 10.48 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 119.21 1.505 . . . . 0.0 110.511 -177.185 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 8.0 t -150.73 170.41 19.3 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.27 1.028 . . . . 0.0 110.874 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 92.0 m -58.17 153.51 14.83 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 127.441 2.296 . . . . 0.0 111.852 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -116.72 -85.75 0.63 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.677 1.591 . . . . 0.0 107.971 -173.425 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -140.66 -174.19 3.9 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 126.97 2.108 . . . . 0.0 108.179 179.411 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 30.2 tptt 48.68 54.59 10.39 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 125.705 1.602 . . . . 0.0 112.624 171.177 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 6.8 tpt 53.92 37.14 25.98 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.657 0.783 . . . . 0.0 110.561 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' HIS . . . . . 0.487 ' O ' ' HD2' ' A' ' 98' ' ' HIS . 6.8 t-160 62.69 -61.83 0.12 Allowed 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 126.62 1.968 . . . . 0.0 111.458 -160.501 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 97.7 mt -135.42 116.9 14.76 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 125.231 1.412 . . . . 0.0 109.169 -156.498 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 25.6 t60 -75.19 -26.31 58.91 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 172.769 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 79.1 p -159.21 172.98 17.07 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 119.481 1.037 . . . . 0.0 112.015 177.291 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 47.5 t -58.14 -43.46 85.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.261 166.366 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 1.2 ttm -55.85 -50.04 71.68 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 118.995 0.816 . . . . 0.0 110.355 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.41 -29.85 69.46 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 120.704 -0.398 . . . . 0.0 110.168 -178.31 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -69.27 -42.77 75.11 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 124.802 1.241 . . . . 0.0 112.823 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 32.7 mm -54.95 -39.86 51.0 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 172.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -69.34 -44.6 71.32 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 119.438 -0.315 . . . . 0.0 111.032 -178.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -57.71 -44.47 85.94 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.257 1.023 . . . . 0.0 111.001 176.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 12.4 mt -54.61 -35.97 63.97 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 124.929 1.292 . . . . 0.0 112.136 173.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -88.58 0.62 56.17 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.438 1.495 . . . . 0.0 112.516 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -112.92 3.52 16.34 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.872 1.669 . . . . 0.0 112.281 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 15.5 mt -76.66 -38.84 53.89 Favored 'General case' 0 CA--C 1.527 0.07 0 C-N-CA 123.439 0.695 . . . . 0.0 109.809 167.074 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -66.75 163.24 19.63 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.805 1.242 . . . . 0.0 110.363 169.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.995 0 CA-C-O 117.488 -1.729 . . . . 0.0 108.827 -174.79 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.9 mmm . . . . . 0 N--CA 1.471 0.595 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 75.87 -117.63 5.18 Favored Glycine 0 C--N 1.333 0.399 0 N-CA-C 110.178 -1.169 . . . . 0.0 110.178 175.05 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -74.04 179.8 4.19 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.654 0.781 . . . . 0.0 111.5 175.663 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 154.51 -30.55 0.69 Allowed Glycine 0 CA--C 1.522 0.488 0 C-N-CA 125.158 1.361 . . . . 0.0 112.126 167.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 14.8 mt-30 60.01 17.69 6.92 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.329 1.852 . . . . 0.0 113.964 172.077 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 19.5 p -129.85 163.59 46.08 Favored Pre-proline 0 C--O 1.237 0.411 0 C-N-CA 128.617 2.767 . . . . 0.0 109.19 -176.363 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -81.9 83.32 2.11 Favored 'Trans proline' 0 N--CA 1.444 -1.44 0 C-N-CA 121.723 1.616 . . . . 0.0 109.172 173.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 74.9 149.33 0.12 Allowed Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 127.706 2.402 . . . . 0.0 111.164 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -73.42 -34.0 6.34 Favored 'Trans proline' 0 CA--C 1.534 0.497 0 C-N-CA 122.007 1.804 . . . . 0.0 112.806 173.487 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -76.47 -11.89 59.95 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 118.807 0.73 . . . . 0.0 112.892 -171.329 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 tt -61.2 142.37 56.83 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.302 0.641 . . . . 0.0 110.066 167.349 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 34.1 mm -124.96 117.77 51.14 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 173.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 81.4 m95 -61.22 151.63 75.25 Favored Pre-proline 0 C--O 1.235 0.323 0 C-N-CA 122.771 0.429 . . . . 0.0 110.779 177.193 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -73.24 168.14 76.87 Favored 'Cis proline' 0 N--CA 1.457 -0.637 0 C-N-CA 125.122 -0.783 . . . . 0.0 114.027 -1.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -137.06 172.91 12.3 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.332 1.053 . . . . 0.0 110.685 177.491 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 17.2 mt -141.41 105.97 4.88 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 126.246 1.818 . . . . 0.0 108.681 -171.593 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 32.5 tp -87.92 150.35 23.53 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 125.262 1.425 . . . . 0.0 109.913 174.501 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -144.53 83.19 1.71 Allowed 'General case' 0 C--O 1.239 0.501 0 CA-C-N 120.176 1.353 . . . . 0.0 110.391 172.567 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -47.77 140.91 5.99 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 125.889 1.676 . . . . 0.0 113.296 -170.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -62.94 117.52 6.52 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.612 0.72 . . . . 0.0 110.642 -179.289 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 119.39 -62.21 0.47 Allowed Glycine 0 N--CA 1.451 -0.355 0 N-CA-C 108.575 -1.81 . . . . 0.0 108.575 -170.588 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -76.1 -179.75 5.16 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 123.434 1.588 . . . . 0.0 112.663 -166.763 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -124.78 -16.72 6.1 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 126.075 1.75 . . . . 0.0 109.319 176.417 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -77.47 109.98 11.86 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 -174.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.521 HD12 ' HB2' ' A' ' 85' ' ' HIS . 0.5 OUTLIER -65.65 148.3 51.98 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 119.604 -0.838 . . . . 0.0 108.947 172.419 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -104.34 87.68 1.78 Allowed Pre-proline 0 N--CA 1.447 -0.619 0 C-N-CA 126.314 1.846 . . . . 0.0 106.45 173.557 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -61.91 132.45 39.73 Favored 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 121.949 1.766 . . . . 0.0 108.526 170.434 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -118.61 103.28 9.56 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.923 1.289 . . . . 0.0 107.577 174.445 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 30.0 mtt180 -66.87 -38.99 87.37 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 119.415 1.007 . . . . 0.0 112.754 -169.366 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 15.5 p -152.55 166.81 30.87 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 126.367 1.867 . . . . 0.0 106.95 -170.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -47.75 -37.85 14.24 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.501 1.046 . . . . 0.0 112.636 175.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.02 -17.9 29.53 Favored 'General case' 0 C--O 1.231 0.095 0 C-N-CA 125.354 1.462 . . . . 0.0 114.275 -177.148 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -87.09 -47.28 9.04 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.479 1.912 . . . . 0.0 110.274 -175.195 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 53.4 t-105 -58.21 -34.69 70.67 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 120.659 -1.276 . . . . 0.0 110.267 176.318 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -51.21 -48.35 62.04 Favored 'General case' 0 C--N 1.341 0.234 0 C-N-CA 123.635 0.774 . . . . 0.0 110.105 173.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 5.2 mtt180 -67.14 -21.88 65.8 Favored 'General case' 0 CA--C 1.517 -0.322 0 C-N-CA 125.711 1.604 . . . . 0.0 112.225 -169.377 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -69.52 -68.32 0.42 Allowed 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.351 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 69.1 m -67.18 -17.17 64.72 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -175.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.77 -9.46 37.19 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.424 1.09 . . . . 0.0 111.78 170.291 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -122.77 55.76 1.17 Allowed 'General case' 0 C--O 1.233 0.207 0 CA-C-O 122.952 1.358 . . . . 0.0 110.014 172.073 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.2 t 71.69 160.23 0.22 Allowed 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 128.64 2.776 . . . . 0.0 111.029 -172.169 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -102.3 46.58 0.92 Allowed 'General case' 0 C--O 1.237 0.399 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 176.151 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -67.07 172.64 4.37 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 107.422 -1.325 . . . . 0.0 107.422 174.738 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . 0.326 36.9 mt 62.12 -154.98 0.35 Allowed 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.972 0.909 . . . . 0.0 111.952 174.426 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.2 mt 75.68 84.51 0.09 Allowed 'General case' 0 C--N 1.34 0.161 0 C-N-CA 125.365 1.466 . . . . 0.0 112.373 163.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -104.11 165.66 10.91 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.301 1.04 . . . . 0.0 111.06 -169.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 17.7 m-85 -73.08 79.29 1.23 Allowed 'General case' 0 C--O 1.234 0.264 0 C-N-CA 125.485 1.514 . . . . 0.0 109.711 177.196 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 150.84 -0.75 0.37 Allowed Glycine 0 N--CA 1.446 -0.696 0 CA-C-N 115.003 -0.999 . . . . 0.0 113.022 -167.148 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.04 -9.4 38.76 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 119.41 1.605 . . . . 0.0 114.621 -168.172 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt 44.23 126.44 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.785 1 C-N-CA 132.993 4.517 . . . . 0.0 114.837 179.756 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.0 tp -120.04 151.21 39.34 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 124.283 1.033 . . . . 0.0 108.252 170.324 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.41 HG11 HD13 ' A' ' 73' ' ' LEU . 33.8 t -134.8 146.27 31.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 105.535 -2.024 . . . . 0.0 105.535 161.496 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -120.95 -171.11 2.13 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 127.782 2.433 . . . . 0.0 110.701 178.477 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 88.8 p -63.93 -29.17 70.37 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -72.47 -14.72 61.74 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 124.121 0.968 . . . . 0.0 112.305 -178.379 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.63 ' CD1' HD22 ' A' ' 73' ' ' LEU . 48.3 m-85 51.15 57.33 6.75 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.196 0.999 . . . . 0.0 111.406 -177.58 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 11.0 m170 -120.75 13.02 11.49 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.377 1.071 . . . . 0.0 113.693 -171.392 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 57.0 m 43.05 124.99 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.541 1 C-N-CA 133.624 4.77 . . . . 0.0 113.573 176.871 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -126.54 141.88 51.72 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 121.362 -0.836 . . . . 0.0 109.171 178.264 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 30.5 t -130.9 146.13 34.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 C-N-CA 127.243 2.217 . . . . 0.0 105.698 169.489 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 21.4 tp -77.19 139.1 39.81 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 124.184 0.994 . . . . 0.0 108.607 177.104 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -108.0 167.2 10.16 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 125.789 1.636 . . . . 0.0 109.67 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -69.72 -9.85 56.02 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.82 0.848 . . . . 0.0 112.493 176.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.3 t0 -81.78 6.6 15.01 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.562 1.545 . . . . 0.0 111.087 166.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 53.01 8.25 0.09 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 128.053 2.541 . . . . 0.0 114.29 -169.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.2 p-80 -79.26 165.91 22.71 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 119.435 1.016 . . . . 0.0 109.405 169.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 75.6 m95 -102.45 122.31 44.07 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 106.838 -1.541 . . . . 0.0 106.838 170.001 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 63.0 t60 -98.99 143.68 26.82 Favored Pre-proline 0 CA--C 1.536 0.431 0 CA-C-O 118.379 -0.819 . . . . 0.0 109.186 -176.607 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -74.52 125.26 9.46 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 124.109 3.206 . . . . 0.0 110.754 173.557 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -116.72 39.33 3.21 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 125.021 1.328 . . . . 0.0 110.426 -168.077 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 67.61 164.35 0.13 Allowed Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 127.98 2.512 . . . . 0.0 111.949 -178.162 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -69.7 174.27 9.71 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.201 1.934 . . . . 0.0 114.26 -172.395 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.63 HD22 ' CD1' ' A' ' 56' ' ' PHE . 8.3 tt -128.75 143.64 49.32 Favored Pre-proline 0 CA--C 1.542 0.652 0 C-N-CA 126.663 1.985 . . . . 0.0 108.411 -175.614 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.463 ' O ' HD23 ' A' ' 73' ' ' LEU . 73.2 Cg_endo -85.6 165.45 10.57 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 123.14 2.56 . . . . 0.0 112.977 -178.137 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -60.15 -14.06 26.94 Favored 'Trans proline' 0 CA--C 1.531 0.361 0 C-N-CA 123.383 2.722 . . . . 0.0 114.77 177.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -101.31 -14.24 17.71 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.251 1.82 . . . . 0.0 112.493 177.13 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -75.22 -25.59 68.25 Favored Glycine 0 CA--C 1.53 1.003 0 O-C-N 121.133 -0.98 . . . . 0.0 112.916 -177.087 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 23.0 tp -50.75 -48.69 59.07 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 118.359 1.08 . . . . 0.0 109.333 166.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -68.31 -21.45 64.77 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.931 -168.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -69.31 -43.55 73.54 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 120.398 1.454 . . . . 0.0 111.565 172.062 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -60.34 -55.4 34.15 Favored 'General case' 0 CA--C 1.522 -0.098 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 175.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.8 mm -58.3 -33.28 47.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 123.609 0.763 . . . . 0.0 110.605 -176.048 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.9 -35.56 45.86 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 119.429 1.013 . . . . 0.0 112.219 175.668 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.26 -61.45 2.35 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 119.212 0.915 . . . . 0.0 109.365 176.173 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.521 ' HB2' HD12 ' A' ' 25' ' ' LEU . 12.8 t-80 -57.98 -36.56 72.78 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.876 0.871 . . . . 0.0 112.194 -175.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 96.7 m -70.39 -54.37 12.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 118.358 -0.83 . . . . 0.0 110.973 175.274 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.14 -24.99 65.06 Favored 'General case' 0 C--O 1.23 0.074 0 CA-C-N 118.862 0.755 . . . . 0.0 112.03 -171.332 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.4 t -76.85 -15.37 59.73 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 118.653 -0.689 . . . . 0.0 110.755 178.304 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 83.6 mt -114.77 -58.28 2.16 Favored 'General case' 0 C--N 1.343 0.324 0 CA-C-N 119.636 1.107 . . . . 0.0 110.6 -174.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 149.36 5.55 0.22 Allowed Glycine 0 CA--C 1.528 0.901 0 CA-C-O 118.93 -0.928 . . . . 0.0 113.9 -173.157 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' HIS . . . . . 0.651 ' CD2' HD13 ' A' ' 112' ' ' LEU . 5.2 m-70 -76.71 142.29 40.57 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 119.511 1.656 . . . . 0.0 110.74 -161.558 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 24.4 t -139.49 72.29 1.4 Allowed 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 124.229 1.012 . . . . 0.0 109.115 -174.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 96.1 m 60.13 176.91 0.09 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.521 1.929 . . . . 0.0 114.597 173.559 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 8.8 t -159.75 61.18 0.37 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 128.359 2.663 . . . . 0.0 109.053 -177.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.4 t 68.96 152.47 0.09 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.562 1.145 . . . . 0.0 111.088 179.05 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.8 ttpt 66.97 -177.2 0.2 Allowed 'General case' 0 N--CA 1.469 0.501 0 O-C-N 120.492 -1.38 . . . . 0.0 111.773 -176.039 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 4.6 tpt -73.78 86.5 1.71 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.488 1.515 . . . . 0.0 108.194 175.123 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 55.8 -76.55 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 127.066 2.146 . . . . 0.0 112.384 -175.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.456 HD13 ' HB2' ' A' ' 105' ' ' ALA . 81.6 mt -147.19 133.67 19.74 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 125.829 1.652 . . . . 0.0 108.102 -173.58 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 47.1 t-80 -67.6 -42.9 81.72 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 124.294 0.996 . . . . 0.0 111.807 179.037 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -170.2 -179.2 3.03 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.243 1.417 . . . . 0.0 109.157 -173.387 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 16.0 t -59.26 -40.62 81.71 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 C-N-CA 123.824 0.85 . . . . 0.0 110.818 -175.28 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -54.15 -45.67 72.08 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.875 0.87 . . . . 0.0 109.829 178.401 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -63.12 -41.53 99.36 Favored 'General case' 0 C--N 1.333 -0.115 0 C-N-CA 124.746 1.218 . . . . 0.0 110.564 -178.288 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.456 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -60.56 -50.17 74.63 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 124.224 1.01 . . . . 0.0 111.135 178.392 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 14.0 mm -66.31 -37.09 78.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -174.147 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -61.91 -47.97 82.54 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 118.763 0.711 . . . . 0.0 110.168 174.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -52.83 -63.7 1.06 Allowed 'General case' 0 C--N 1.342 0.257 0 C-N-CA 125.323 1.449 . . . . 0.0 111.59 179.244 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.411 ' HG ' ' CE1' ' A' ' 85' ' ' HIS . 8.7 mp -51.43 -47.0 63.15 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.702 1.201 . . . . 0.0 110.993 -179.617 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -73.28 -18.36 61.22 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 121.663 -0.648 . . . . 0.0 112.377 -178.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -85.48 -22.85 28.05 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.357 1.063 . . . . 0.0 111.418 176.127 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.651 HD13 ' CD2' ' A' ' 91' ' ' HIS . 22.5 mt -69.17 -61.5 1.77 Allowed 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.133 0.973 . . . . 0.0 109.065 172.591 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -63.18 159.72 17.02 Favored 'General case' 0 C--O 1.24 0.584 0 N-CA-C 114.042 1.127 . . . . 0.0 114.042 -170.217 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.808 0 CA-C-O 118.321 -1.266 . . . . 0.0 110.985 171.272 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.467 0.42 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 159.34 81.95 0.04 OUTLIER Glycine 0 N--CA 1.445 -0.729 0 N-CA-C 108.554 -1.818 . . . . 0.0 108.554 173.78 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.2 134.18 56.28 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-N 117.057 0.429 . . . . 0.0 110.54 -172.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 176.17 167.3 34.78 Favored Glycine 0 CA--C 1.521 0.453 0 C-N-CA 125.163 1.363 . . . . 0.0 110.435 178.117 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 60.59 9.48 2.13 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 126.7 2.0 . . . . 0.0 115.073 -177.185 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 10.3 p -64.78 154.56 85.21 Favored Pre-proline 0 C--N 1.321 -0.664 0 C-N-CA 125.066 1.346 . . . . 0.0 110.771 173.235 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -79.31 90.2 1.29 Allowed 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 123.865 3.043 . . . . 0.0 110.258 -178.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 74.54 144.72 0.11 Allowed Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 127.898 2.479 . . . . 0.0 111.194 -175.218 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -77.94 -20.41 11.69 Favored 'Trans proline' 0 CA--C 1.535 0.534 0 C-N-CA 122.349 2.032 . . . . 0.0 113.507 -178.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -90.22 -15.89 30.51 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.256 0.622 . . . . 0.0 112.634 -175.088 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.8 tt -62.74 142.49 58.12 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 118.936 0.789 . . . . 0.0 109.806 170.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 18.2 mm -126.95 136.47 60.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 C-N-CA 124.194 0.998 . . . . 0.0 108.607 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 75.1 m95 -77.94 156.86 79.56 Favored Pre-proline 0 CA--C 1.543 0.693 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 -178.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -67.34 163.33 74.14 Favored 'Cis proline' 0 N--CA 1.458 -0.568 0 C-N-CA 124.633 -0.986 . . . . 0.0 113.355 -9.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -131.79 171.22 13.79 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.218 1.807 . . . . 0.0 110.016 176.171 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.7 mt -141.52 107.13 5.07 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 125.611 1.564 . . . . 0.0 107.63 -174.256 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.1 tp -84.14 151.27 24.99 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 169.306 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.453 ' HE3' ' O ' ' A' ' 22' ' ' CYS . 0.1 OUTLIER -142.58 91.5 2.32 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 171.894 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -48.31 136.0 12.92 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 124.522 1.139 . . . . 0.0 110.939 -168.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -66.28 91.5 0.17 Allowed 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 122.122 0.963 . . . . 0.0 111.808 -172.172 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 137.73 -40.43 1.49 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 124.942 1.258 . . . . 0.0 110.308 -178.56 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.453 ' O ' ' HE3' ' A' ' 18' ' ' LYS . 62.7 m -65.71 173.16 2.97 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 121.544 0.687 . . . . 0.0 110.281 177.876 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -122.04 -32.36 3.72 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 176.504 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -60.76 137.89 58.16 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 124.682 1.193 . . . . 0.0 108.417 170.582 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.4 mt -87.46 154.07 20.93 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 124.427 1.091 . . . . 0.0 108.987 168.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -111.91 86.72 7.71 Favored Pre-proline 0 CA--C 1.542 0.64 0 N-CA-C 105.847 -1.908 . . . . 0.0 105.847 175.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -60.56 140.74 92.81 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 123.936 3.091 . . . . 0.0 109.412 174.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.5 mt -132.89 96.69 3.84 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 106.654 -1.61 . . . . 0.0 106.654 -178.066 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.8 mtt-85 -53.7 -45.6 70.45 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 124.27 1.028 . . . . 0.0 110.882 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.4 t -157.19 178.14 10.68 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 -172.476 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -56.84 -34.65 67.97 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 123.716 0.807 . . . . 0.0 111.696 171.178 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -63.07 -17.74 62.61 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.539 1.063 . . . . 0.0 111.601 177.363 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -81.55 -44.71 16.93 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.689 1.596 . . . . 0.0 109.03 175.453 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 57.6 t-105 -57.72 -33.01 67.97 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.051 1.741 . . . . 0.0 112.481 174.532 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 -65.03 -50.25 66.96 Favored 'General case' 0 C--O 1.232 0.155 0 O-C-N 120.436 -1.415 . . . . 0.0 110.769 172.109 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 50.6 mtp85 -60.58 -31.74 70.87 Favored 'General case' 0 C--O 1.227 -0.119 0 CA-C-O 117.207 -1.378 . . . . 0.0 112.091 -175.802 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -49.93 -60.37 2.99 Favored 'General case' 0 N--CA 1.462 0.14 0 C-N-CA 124.42 1.088 . . . . 0.0 110.756 174.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 17.5 p -70.77 -35.07 72.43 Favored 'General case' 0 N--CA 1.453 -0.322 0 O-C-N 122.057 -0.402 . . . . 0.0 110.961 -174.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.05 -27.48 69.13 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 118.941 -0.552 . . . . 0.0 111.094 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -65.4 2.89 0.77 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.518 1.527 . . . . 0.0 113.277 -178.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.9 t 75.73 9.27 3.54 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 127.809 2.443 . . . . 0.0 110.46 -169.19 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -115.21 44.22 1.87 Allowed 'General case' 0 C--O 1.221 -0.441 0 C-N-CA 125.418 1.487 . . . . 0.0 112.286 -168.59 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.63 20.54 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 116.629 2.085 . . . . 0.0 116.629 -178.783 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.14 115.66 3.63 Favored 'General case' 0 N--CA 1.439 -0.977 0 C-N-CA 126.607 1.963 . . . . 0.0 110.087 -171.368 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 81.1 mt -144.37 126.24 15.32 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 -179.306 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -136.95 157.58 46.42 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 124.621 1.168 . . . . 0.0 109.545 -173.191 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -65.2 121.33 14.52 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 107.513 -1.291 . . . . 0.0 107.513 179.481 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 97.1 10.77 54.37 Favored Glycine 0 CA--C 1.535 1.299 0 CA-C-O 117.482 -1.732 . . . . 0.0 114.404 -177.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.3 -13.67 41.25 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-N 120.441 2.121 . . . . 0.0 115.466 178.52 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt 47.73 144.46 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.531 1 C-N-CA 134.815 5.246 . . . . 0.0 114.632 -176.721 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 14.8 mt -126.58 156.21 41.23 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 166.271 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 17.3 t -130.57 141.8 45.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 N-CA-C 104.552 -2.388 . . . . 0.0 104.552 163.422 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -98.66 179.78 4.56 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.276 1.03 . . . . 0.0 110.539 173.129 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.6 m -61.98 -3.09 1.07 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 115.881 1.808 . . . . 0.0 115.881 174.573 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 -120.79 16.2 11.84 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 127.04 2.136 . . . . 0.0 110.368 -176.076 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 65.33 13.94 9.11 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.819 2.048 . . . . 0.0 112.874 175.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 31.1 m170 -69.04 110.0 4.27 Favored 'General case' 0 C--N 1.329 -0.285 0 O-C-N 120.191 -1.568 . . . . 0.0 109.121 174.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -71.22 143.74 50.34 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 119.501 1.046 . . . . 0.0 108.76 167.524 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -135.65 159.49 41.47 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 125.397 1.479 . . . . 0.0 109.602 -179.326 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 30.3 t -141.64 141.33 30.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 C-N-CA 128.158 2.583 . . . . 0.0 105.961 -174.007 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 22.8 tp -94.42 132.73 38.76 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 128.299 2.64 . . . . 0.0 105.657 174.046 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 73.3 mt-10 -128.99 174.72 9.28 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.291 1.036 . . . . 0.0 112.11 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -68.38 -18.5 64.48 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 125.622 1.569 . . . . 0.0 114.516 -166.471 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -77.0 12.34 1.43 Allowed 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.067 1.347 . . . . 0.0 111.256 174.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 45.91 48.48 12.16 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 126.241 1.816 . . . . 0.0 109.693 -170.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -120.44 161.51 21.11 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.544 0.687 . . . . 0.0 110.876 162.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 81.6 m95 -94.75 154.56 17.23 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 106.043 -1.836 . . . . 0.0 106.043 158.251 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -142.46 161.34 50.45 Favored Pre-proline 0 CA--C 1.54 0.569 0 C-N-CA 123.935 0.894 . . . . 0.0 111.079 -176.02 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.04 134.42 27.35 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 124.313 3.342 . . . . 0.0 111.153 172.782 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -129.01 21.11 5.83 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.234 1.414 . . . . 0.0 112.833 -176.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 75.59 154.5 0.15 Allowed Pre-proline 0 CA--C 1.539 0.551 0 C-N-CA 131.479 3.912 . . . . 0.0 113.496 -177.22 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -72.0 163.58 38.34 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 121.756 1.638 . . . . 0.0 113.419 -176.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.4 tt -102.37 143.58 26.9 Favored Pre-proline 0 CA--C 1.545 0.762 0 C-N-CA 126.263 1.825 . . . . 0.0 109.273 -173.507 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -83.01 166.82 14.54 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 123.954 3.103 . . . . 0.0 111.706 -176.04 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -64.14 -21.27 67.84 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 121.626 1.551 . . . . 0.0 112.96 -175.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -90.34 -20.45 22.85 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.652 1.581 . . . . 0.0 112.928 175.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.02 -32.55 84.53 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-N 119.518 1.054 . . . . 0.0 111.104 -175.645 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 32.5 tp -59.67 -51.23 70.67 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.065 0.946 . . . . 0.0 108.511 178.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -61.28 -25.05 66.84 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.274 1.829 . . . . 0.0 111.061 178.871 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -76.43 -47.5 22.87 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.524 1.056 . . . . 0.0 111.029 176.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.42 HD13 ' HA ' ' A' ' 81' ' ' LEU . 1.4 mm? -61.2 -50.35 73.47 Favored 'General case' 0 CA--C 1.521 -0.16 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 177.24 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.7 mm -53.73 -42.24 50.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 C-N-CA 124.022 0.929 . . . . 0.0 109.672 -179.015 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.9 ttt85 -51.38 -38.57 54.01 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 120.017 1.28 . . . . 0.0 113.614 177.379 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.15 -49.64 75.06 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 119.774 1.17 . . . . 0.0 109.987 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 24.0 t60 -60.69 -46.0 92.05 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.863 0.865 . . . . 0.0 109.716 176.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 73.2 m -65.04 -34.47 78.51 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 118.297 -0.859 . . . . 0.0 111.886 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -71.45 -40.82 70.11 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 119.019 0.827 . . . . 0.0 111.122 -177.566 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 8.6 t -71.42 -35.04 70.82 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 118.989 -0.529 . . . . 0.0 110.187 -175.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 64.3 mt -78.42 -47.13 18.2 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 175.582 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 99.04 53.33 1.18 Allowed Glycine 0 CA--C 1.527 0.838 0 C-N-CA 127.247 2.356 . . . . 0.0 110.625 -178.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 35.3 m-70 -112.27 -178.7 3.48 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 126.118 1.767 . . . . 0.0 111.688 -177.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 5.3 m -117.58 161.13 20.12 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.94 1.296 . . . . 0.0 110.874 -172.669 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 29.3 p -70.98 22.86 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 126.787 2.035 . . . . 0.0 114.076 -179.314 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . 0.268 1.7 t 44.03 -87.94 0.01 OUTLIER 'General case' 0 C--O 1.237 0.403 0 C-N-CA 130.18 3.392 . . . . 0.0 111.9 -176.097 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 5.0 p -165.81 -164.23 0.7 Allowed 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 128.598 2.759 . . . . 0.0 105.753 171.14 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.445 ' HE3' ' HB2' ' A' ' 100' ' ' HIS . 1.6 ttpt 57.36 46.47 18.27 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.389 0.541 . . . . 0.0 112.173 165.319 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 37.4 ttp 59.8 46.08 11.87 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 124.486 1.115 . . . . 0.0 110.968 171.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 8.5 m80 62.75 -66.7 0.09 Allowed 'General case' 0 C--O 1.232 0.16 0 C-N-CA 127.373 2.269 . . . . 0.0 109.539 -159.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.522 HD13 ' HB2' ' A' ' 105' ' ' ALA . 94.1 mt -145.5 154.41 42.18 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 126.205 1.802 . . . . 0.0 108.503 -165.05 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' HIS . . . . . 0.445 ' HB2' ' HE3' ' A' ' 96' ' ' LYS . 53.8 t-80 -96.41 -28.78 14.29 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.127 -0.488 . . . . 0.0 112.271 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.6 t -171.63 179.85 2.72 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.432 1.493 . . . . 0.0 108.508 -177.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 60.6 t -65.21 -37.09 79.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 O-C-N 121.325 -0.859 . . . . 0.0 110.989 -177.445 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 3.7 tpt -59.05 -38.56 79.65 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 121.916 -0.49 . . . . 0.0 109.919 177.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -63.73 -44.31 93.94 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 124.27 1.028 . . . . 0.0 109.166 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.522 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -55.67 -52.0 65.32 Favored 'General case' 0 C--N 1.34 0.195 0 C-N-CA 125.599 1.56 . . . . 0.0 112.404 -178.221 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 30.0 mm -61.98 -44.08 98.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 -175.491 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.68 -40.78 92.71 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.151 0.58 . . . . 0.0 110.418 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -55.28 -55.17 34.5 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 124.318 1.047 . . . . 0.0 109.686 176.02 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 6.8 mt -61.64 -45.57 93.48 Favored 'General case' 0 CA--C 1.517 -0.315 0 O-C-N 124.182 0.926 . . . . 0.0 110.679 -176.606 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 -59.35 -43.41 92.81 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 118.988 -0.53 . . . . 0.0 110.065 179.378 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.8 -12.76 61.86 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 -177.388 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 57.2 mt -67.03 -63.57 1.03 Allowed 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 120.155 1.343 . . . . 0.0 109.162 177.254 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 54.34 32.95 17.39 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 128.688 2.795 . . . . 0.0 113.802 -179.288 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.206 0 C-N-CA 126.986 2.231 . . . . 0.0 108.607 172.19 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.6 ptp . . . . . 0 N--CA 1.474 0.77 0 CA-C-O 117.673 -1.156 . . . . 0.0 112.276 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -55.93 -62.28 6.49 Favored Glycine 0 C--N 1.341 0.823 0 CA-C-N 118.872 0.76 . . . . 0.0 111.791 -176.021 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 53.83 -154.32 0.25 Allowed 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 117.408 0.604 . . . . 0.0 110.883 -175.499 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -160.18 -168.42 22.1 Favored Glycine 0 CA--C 1.523 0.55 0 O-C-N 120.867 -1.146 . . . . 0.0 110.907 -177.144 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -134.58 86.23 2.25 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 -171.24 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -149.06 155.21 40.19 Favored Pre-proline 0 C--N 1.321 -0.658 0 C-N-CA 124.638 1.175 . . . . 0.0 110.816 -173.435 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -68.4 -54.66 0.28 Allowed 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.598 2.199 . . . . 0.0 111.931 176.775 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 20.3 t-80 -161.94 144.21 8.71 Favored Pre-proline 0 CA--C 1.536 0.427 0 CA-C-N 119.853 1.206 . . . . 0.0 108.661 174.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -73.64 -1.73 11.16 Favored 'Trans proline' 0 CA--C 1.536 0.609 0 C-N-CA 122.93 2.42 . . . . 0.0 114.216 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -113.11 -3.93 13.89 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.743 1.217 . . . . 0.0 112.23 177.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.7 tt -66.77 117.02 8.31 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 163.339 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 29.4 mm -100.05 103.9 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 177.492 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 71.9 m95 -53.47 150.51 12.28 Favored Pre-proline 0 CA--C 1.533 0.292 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.761 176.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -68.88 167.91 66.2 Favored 'Cis proline' 0 N--CA 1.456 -0.696 0 N-CA-C 114.878 1.069 . . . . 0.0 114.878 -0.601 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -139.23 167.78 21.3 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 124.831 1.252 . . . . 0.0 110.741 -179.483 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.5 mt -140.53 114.32 8.9 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 125.734 1.613 . . . . 0.0 108.488 -172.239 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.481 HD11 ' HB3' ' A' ' 49' ' ' ASP . 18.7 tp -95.7 143.77 26.67 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.602 1.561 . . . . 0.0 109.015 178.606 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -146.21 98.05 3.03 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 119.616 1.098 . . . . 0.0 110.769 175.485 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -58.87 160.31 5.99 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-O 122.687 1.232 . . . . 0.0 112.658 -173.457 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -76.12 99.87 4.8 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 122.63 1.205 . . . . 0.0 111.981 174.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 126.89 -39.43 1.97 Allowed Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 126.229 1.871 . . . . 0.0 108.506 169.326 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 41.6 m -65.67 165.07 13.18 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 124.568 1.147 . . . . 0.0 109.647 174.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 -122.16 -28.16 4.42 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 124.914 1.286 . . . . 0.0 109.539 -178.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -60.82 115.11 3.43 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 127.825 2.45 . . . . 0.0 109.177 -178.048 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -72.4 147.61 46.04 Favored 'General case' 0 N--CA 1.463 0.197 0 O-C-N 121.103 -0.998 . . . . 0.0 109.496 172.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.06 87.61 9.08 Favored Pre-proline 0 CA--C 1.535 0.369 0 C-N-CA 125.48 1.512 . . . . 0.0 108.945 176.084 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -63.48 127.54 20.15 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 122.641 2.227 . . . . 0.0 110.73 172.448 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -114.72 107.75 15.87 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 125.996 1.718 . . . . 0.0 107.604 169.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.7 mtt-85 -61.85 -45.79 92.29 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.045 0.384 . . . . 0.0 111.186 -178.248 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 13.3 t -146.85 -176.1 5.07 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 121.918 0.866 . . . . 0.0 110.54 174.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -54.44 -38.35 66.21 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 124.789 1.236 . . . . 0.0 110.085 -179.557 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.73 -19.85 63.54 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 121.423 0.63 . . . . 0.0 111.498 -177.373 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -78.47 -35.12 47.05 Favored 'General case' 0 CA--C 1.521 -0.164 0 O-C-N 120.151 -1.593 . . . . 0.0 109.923 175.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 49.9 t-105 -64.03 -34.93 79.12 Favored 'General case' 0 C--O 1.234 0.266 0 O-C-N 121.455 -0.778 . . . . 0.0 110.615 170.564 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -57.5 -57.15 13.96 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-O 118.834 -0.603 . . . . 0.0 109.771 168.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.544 ' HA ' ' HB3' ' A' ' 39' ' ' ALA . 0.0 OUTLIER -72.83 -20.22 61.18 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 117.543 -1.663 . . . . 0.0 109.632 -168.499 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -52.15 -64.31 0.86 Allowed 'General case' 0 CA--C 1.519 -0.233 0 O-C-N 120.149 -1.594 . . . . 0.0 109.343 -177.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 1.9 m -80.48 -16.2 54.9 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-O 116.614 -1.66 . . . . 0.0 111.139 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.544 ' HB3' ' HA ' ' A' ' 36' ' ' ARG . . . -51.93 -45.46 64.3 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 120.344 1.429 . . . . 0.0 110.821 160.494 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -115.26 -4.74 12.38 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -156.135 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 8.1 t -144.81 -21.55 0.51 Allowed 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.628 1.171 . . . . 0.0 112.522 -174.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.2 pttt 44.47 26.1 0.16 Allowed 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 128.47 2.708 . . . . 0.0 115.351 176.571 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -60.33 150.84 29.36 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.88 0.848 . . . . 0.0 110.818 -159.444 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.1 tt -56.18 129.01 38.37 Favored 'General case' 0 N--CA 1.439 -0.99 0 C-N-CA 125.971 1.708 . . . . 0.0 110.022 175.435 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 57.9 mt -111.57 124.3 52.0 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.914 1.286 . . . . 0.0 107.646 -179.828 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -129.7 147.21 51.46 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.656 1.582 . . . . 0.0 107.943 -177.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.591 ' HA ' HD13 ' A' ' 61' ' ' LEU . 40.3 m-85 -67.16 91.32 0.22 Allowed 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 124.858 1.263 . . . . 0.0 110.629 -167.435 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 140.48 15.93 0.48 Allowed Glycine 0 CA--C 1.528 0.889 0 C-N-CA 124.203 0.906 . . . . 0.0 113.336 -179.187 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.481 ' HB3' HD11 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -56.13 -9.97 0.74 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 127.768 2.427 . . . . 0.0 115.321 171.779 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.2 ttmt 44.42 115.69 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 130.808 3.643 . . . . 0.0 113.737 175.536 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 16.1 mt -104.42 155.19 19.0 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 167.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 23.7 t -136.81 142.94 36.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 N-CA-C 105.952 -1.87 . . . . 0.0 105.952 160.437 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.68 -170.56 1.78 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.829 1.652 . . . . 0.0 111.018 179.126 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.6 m -72.55 -15.69 61.76 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 176.499 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 -80.14 -3.95 50.93 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.829 1.251 . . . . 0.0 112.469 168.337 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 63.88 19.49 11.76 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.521 1.128 . . . . 0.0 109.88 -170.009 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 66.6 m170 -67.06 107.44 2.28 Favored 'General case' 0 CA--C 1.518 -0.266 0 O-C-N 120.215 -1.553 . . . . 0.0 106.918 170.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -74.04 153.86 39.49 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 121.952 0.882 . . . . 0.0 109.577 168.552 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -135.4 167.95 20.11 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 125.784 1.633 . . . . 0.0 108.511 -178.531 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 53.4 t -145.21 142.01 22.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 104.772 -2.307 . . . . 0.0 104.772 172.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.591 HD13 ' HA ' ' A' ' 47' ' ' TYR . 0.1 OUTLIER -81.6 124.53 29.62 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 106.379 -1.712 . . . . 0.0 106.379 170.461 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -109.21 161.25 15.41 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 118.516 0.598 . . . . 0.0 109.533 -178.496 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -55.84 -14.84 2.63 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -175.528 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.93 -11.04 57.98 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.937 1.295 . . . . 0.0 112.78 170.613 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 74.45 8.16 4.49 Favored 'General case' 0 C--N 1.351 0.643 0 C-N-CA 126.236 1.815 . . . . 0.0 111.193 -165.33 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -94.26 164.35 13.07 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 118.783 0.72 . . . . 0.0 111.403 177.081 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -107.96 107.28 17.91 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 107.645 -1.242 . . . . 0.0 107.645 173.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 -79.98 143.58 57.72 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -71.78 105.27 1.76 Allowed 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 124.606 3.537 . . . . 0.0 109.815 170.329 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.92 28.69 0.09 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.061 1.344 . . . . 0.0 111.559 170.026 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.494 ' HB1' ' HD2' ' A' ' 72' ' ' PRO . . . 67.8 166.71 0.12 Allowed Pre-proline 0 CA--C 1.539 0.53 0 C-N-CA 125.79 1.636 . . . . 0.0 111.602 -178.466 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.494 ' HD2' ' HB1' ' A' ' 71' ' ' ALA . 72.0 Cg_endo -64.36 162.88 28.62 Favored 'Trans proline' 0 N--CA 1.45 -1.052 0 C-N-CA 120.47 0.78 . . . . 0.0 110.925 168.609 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 20.7 tp -122.67 144.63 43.01 Favored Pre-proline 0 N--CA 1.448 -0.575 0 C-N-CA 126.717 2.007 . . . . 0.0 106.262 -178.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -62.24 160.68 29.8 Favored 'Trans proline' 0 N--CA 1.453 -0.91 0 C-N-CA 121.608 1.538 . . . . 0.0 110.445 174.191 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -59.97 -25.12 78.72 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 122.28 1.987 . . . . 0.0 112.487 179.168 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -89.2 -20.04 24.68 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 126.549 1.94 . . . . 0.0 109.764 -174.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.06 -23.17 78.37 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 123.814 0.721 . . . . 0.0 112.432 176.588 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 27.9 tp -55.66 -46.99 77.42 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.311 1.044 . . . . 0.0 109.847 169.243 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -58.45 -26.17 63.03 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.452 1.501 . . . . 0.0 111.379 -175.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -74.79 -24.35 58.64 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.18 1.392 . . . . 0.0 113.158 177.436 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 93.7 mt -84.94 -53.56 5.23 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 175.71 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.7 mm -56.74 -28.06 27.11 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 125.395 1.478 . . . . 0.0 110.258 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -44.14 -46.45 8.75 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 125.581 1.552 . . . . 0.0 111.172 174.418 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.73 -48.77 77.77 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 123.525 0.73 . . . . 0.0 111.718 -176.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.441 ' NE2' HD12 ' A' ' 112' ' ' LEU . 13.0 t60 -59.32 -46.62 88.11 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.368 0.667 . . . . 0.0 109.716 177.694 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 78.2 m -68.92 -31.99 71.28 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 120.896 -1.127 . . . . 0.0 111.129 -178.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -80.63 -12.51 59.49 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 125.111 1.365 . . . . 0.0 113.557 -179.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.0 t -95.57 -4.41 44.7 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.107 0.867 . . . . 0.0 110.981 170.672 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 88.9 mt -122.72 -46.84 2.1 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 119.89 1.223 . . . . 0.0 111.66 -174.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 119.95 57.59 0.25 Allowed Glycine 0 CA--C 1.528 0.891 0 C-N-CA 125.239 1.399 . . . . 0.0 112.529 178.125 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -130.84 159.77 36.38 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 118.975 1.388 . . . . 0.0 112.674 -179.183 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 96.4 m -138.22 -56.51 0.65 Allowed 'General case' 0 C--N 1.348 0.503 0 C-N-CA 124.38 1.072 . . . . 0.0 112.918 175.041 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 4.6 p 176.68 154.7 0.23 Allowed 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 126.438 1.895 . . . . 0.0 111.649 178.139 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 9.8 t -149.11 144.92 26.95 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.166 1.386 . . . . 0.0 108.348 -179.318 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 75.7 m 54.63 -63.48 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 128.268 2.627 . . . . 0.0 115.905 -174.207 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.61 ' HE3' ' HB2' ' A' ' 100' ' ' HIS . 0.0 OUTLIER -109.04 -158.03 0.63 Allowed 'General case' 0 C--O 1.238 0.477 0 C-N-CA 125.08 1.352 . . . . 0.0 109.257 -176.543 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.42 ' HG2' ' H ' ' A' ' 98' ' ' HIS . 8.5 ttp -64.96 179.43 0.68 Allowed 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 172.188 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' HIS . . . . . 0.42 ' H ' ' HG2' ' A' ' 97' ' ' MET . 17.2 t-160 -44.58 -60.88 1.77 Allowed 'General case' 0 CA--C 1.519 -0.245 0 C-N-CA 126.584 1.953 . . . . 0.0 111.86 179.536 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.614 HD13 ' HB2' ' A' ' 105' ' ' ALA . 84.2 mt -138.85 146.76 41.6 Favored 'General case' 0 CA--C 1.514 -0.43 0 C-N-CA 124.647 1.179 . . . . 0.0 107.907 169.306 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' HIS . . . . . 0.61 ' HB2' ' HE3' ' A' ' 96' ' ' LYS . 12.1 t-80 -79.45 -36.31 39.06 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 124.557 1.143 . . . . 0.0 112.539 -179.671 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 24.2 p -170.64 174.0 5.19 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 126.18 1.792 . . . . 0.0 108.625 -177.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 68.7 t -62.62 -45.74 98.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-O 118.714 -0.66 . . . . 0.0 109.929 177.067 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 46.8 tpp -62.77 -46.05 89.82 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.843 1.201 . . . . 0.0 110.155 -177.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.29 -35.44 69.8 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 178.459 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.614 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -62.42 -41.77 98.94 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 123.652 0.781 . . . . 0.0 112.492 174.332 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 29.1 mm -56.02 -49.99 72.33 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-N 119.364 0.984 . . . . 0.0 108.889 -177.573 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.67 -40.73 63.47 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.123 -176.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.445 ' CE2' HD11 ' A' ' 112' ' ' LEU . 90.4 t80 -50.29 -59.16 4.24 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.535 0.734 . . . . 0.0 111.454 173.736 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 74.4 mt -58.29 -35.57 72.0 Favored 'General case' 0 CA--C 1.522 -0.125 0 C-N-CA 125.289 1.436 . . . . 0.0 112.159 -174.487 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -69.16 -46.12 68.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 119.227 -0.416 . . . . 0.0 110.355 174.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -69.61 -11.65 61.01 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.132 0.973 . . . . 0.0 112.829 -178.132 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.445 HD11 ' CE2' ' A' ' 108' ' ' PHE . 19.8 mt -71.71 -37.39 70.66 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 119.279 0.945 . . . . 0.0 110.687 169.849 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.8 172.81 12.88 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-O 122.043 0.925 . . . . 0.0 109.762 172.896 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.846 0 N-CA-C 107.809 -2.116 . . . . 0.0 107.809 171.903 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 40.2 tpp . . . . . 0 N--CA 1.469 0.508 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -121.76 -169.57 13.63 Favored Glycine 0 CA--C 1.523 0.537 0 C-N-CA 123.36 0.505 . . . . 0.0 113.248 -154.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -76.97 166.85 22.77 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 125.593 1.557 . . . . 0.0 110.704 176.059 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.67 -8.73 87.18 Favored Glycine 0 CA--C 1.531 1.04 0 O-C-N 121.816 -0.552 . . . . 0.0 113.641 -178.272 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 12.8 mp0 -90.6 10.24 26.41 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 118.289 1.044 . . . . 0.0 113.012 -170.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 14.2 p -126.85 159.87 62.0 Favored Pre-proline 0 C--O 1.239 0.519 0 CA-C-N 118.466 0.575 . . . . 0.0 109.499 -176.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -97.47 84.06 0.07 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.173 0 C-N-CA 122.61 2.207 . . . . 0.0 110.588 -177.322 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 75.4 143.66 0.1 OUTLIER Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 128.91 2.884 . . . . 0.0 110.455 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -84.11 -15.89 6.47 Favored 'Trans proline' 0 CA--C 1.535 0.548 0 C-N-CA 122.921 2.414 . . . . 0.0 112.21 175.476 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.9 -13.52 59.98 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.736 0.814 . . . . 0.0 110.559 175.74 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 tt -68.43 130.97 44.46 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-N 118.385 0.539 . . . . 0.0 110.542 169.448 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 8.0 mm -119.08 102.55 13.16 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 126.602 1.961 . . . . 0.0 108.258 -179.199 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 84.5 m95 -58.84 148.83 67.42 Favored Pre-proline 0 CA--C 1.54 0.566 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 -175.327 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.99 172.45 56.93 Favored 'Cis proline' 0 N--CA 1.455 -0.776 0 N-CA-C 114.271 0.835 . . . . 0.0 114.271 5.348 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.449 ' HB1' HD22 ' A' ' 51' ' ' LEU . . . -144.17 166.11 25.96 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.306 172.925 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.9 mt -132.91 105.97 7.42 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 125.29 1.436 . . . . 0.0 107.333 -178.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 29.9 tp -66.9 142.03 57.44 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 171.321 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.14 94.53 2.54 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 107.47 -1.307 . . . . 0.0 107.47 165.365 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -59.32 155.9 13.7 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 126.013 1.725 . . . . 0.0 110.145 -173.215 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -63.79 116.47 5.78 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 127.453 2.301 . . . . 0.0 109.726 -173.228 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 79.9 -11.22 35.79 Favored Glycine 0 CA--C 1.528 0.898 0 CA-C-O 118.523 -1.154 . . . . 0.0 113.516 178.516 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 50.7 m -72.05 178.14 3.96 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.644 1.722 . . . . 0.0 109.688 167.419 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -142.47 -22.13 0.67 Allowed 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 125.166 1.386 . . . . 0.0 111.704 -178.89 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.49 148.14 49.92 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 166.849 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -104.96 150.09 25.2 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 170.831 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.448 HD22 ' HA ' ' A' ' 26' ' ' LEU . 0.2 OUTLIER -106.75 88.54 3.58 Favored Pre-proline 0 C--O 1.234 0.254 0 C-N-CA 126.923 2.089 . . . . 0.0 110.883 175.372 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -56.82 131.32 44.85 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.579 2.186 . . . . 0.0 110.337 177.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -123.55 97.63 5.47 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 125.91 1.684 . . . . 0.0 107.477 172.09 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.5 mtt85 -56.18 -45.54 79.71 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 118.584 0.629 . . . . 0.0 110.939 177.298 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 12.3 t -148.82 -175.6 5.01 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 121.737 0.779 . . . . 0.0 110.054 173.164 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -54.12 -34.58 60.66 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.176 1.39 . . . . 0.0 111.61 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -61.22 -41.23 96.48 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.216 0.532 . . . . 0.0 109.878 178.281 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.422 ' HA ' ' HD2' ' A' ' 36' ' ' ARG . 16.9 m-20 -70.49 -27.87 64.54 Favored 'General case' 0 C--O 1.232 0.141 0 C-N-CA 125.471 1.508 . . . . 0.0 110.639 -177.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 42.5 t-105 -68.08 -50.97 51.67 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.989 0.916 . . . . 0.0 110.242 166.566 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -58.76 -38.9 79.48 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 118.723 0.692 . . . . 0.0 110.115 -177.308 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.422 ' HD2' ' HA ' ' A' ' 33' ' ' ASP . 63.6 mtt180 -59.55 -13.42 9.14 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 177.052 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -77.68 -66.98 0.77 Allowed 'General case' 0 CA--C 1.528 0.116 0 CA-C-N 120.844 1.657 . . . . 0.0 108.841 167.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 16.8 p -69.0 -13.69 62.61 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 114.467 1.284 . . . . 0.0 114.467 -172.628 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -82.58 -21.92 35.05 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 125.581 1.552 . . . . 0.0 112.63 172.723 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -149.22 2.1 0.56 Allowed 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 115.357 1.614 . . . . 0.0 115.357 -156.75 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 44.6 t -149.77 -65.68 0.21 Allowed 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 -174.482 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 33.8 pttt 56.1 23.26 6.71 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 117.569 2.433 . . . . 0.0 117.569 159.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -117.02 11.9 14.41 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 115.15 1.537 . . . . 0.0 115.15 -166.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.403 ' O ' HD23 ' A' ' 45' ' ' LEU . 12.8 mt -152.61 79.12 1.21 Allowed 'General case' 0 N--CA 1.432 -1.332 0 CA-C-N 115.058 -0.973 . . . . 0.0 108.934 -159.021 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.403 HD23 ' O ' ' A' ' 44' ' ' LEU . 92.8 mt -149.31 101.83 3.16 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 -175.596 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -122.07 156.39 33.67 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.752 1.221 . . . . 0.0 109.265 -167.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.477 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 14.8 m-85 -68.59 96.18 0.69 Allowed 'General case' 0 C--O 1.233 0.236 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 174.298 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 131.31 7.61 3.13 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 124.153 0.883 . . . . 0.0 113.516 -176.09 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.43 -20.56 55.98 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 116.142 1.905 . . . . 0.0 116.142 -168.39 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.565 ' H ' HG23 ' A' ' 60' ' ' VAL . 11.0 ttmt 44.59 128.54 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 130.784 3.634 . . . . 0.0 118.572 171.462 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.449 HD22 ' HB1' ' A' ' 15' ' ' ALA . 5.3 mt -127.86 151.98 48.39 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 124.605 1.162 . . . . 0.0 109.079 178.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 81.6 t -127.03 142.11 44.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 N-CA-C 104.959 -2.237 . . . . 0.0 104.959 163.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 14.3 p-10 -107.56 176.51 5.13 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 124.736 1.214 . . . . 0.0 110.872 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.23 -11.31 30.01 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.103 0.961 . . . . 0.0 112.846 -179.841 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -99.83 6.05 45.4 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.475 1.51 . . . . 0.0 110.37 179.333 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 66.25 18.32 10.9 Favored 'General case' 0 C--N 1.344 0.36 0 C-N-CA 127.158 2.183 . . . . 0.0 112.075 -178.061 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 31.1 m-70 -75.31 117.28 16.95 Favored 'General case' 0 N--CA 1.443 -0.803 0 O-C-N 120.99 -1.069 . . . . 0.0 108.892 175.525 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 57.1 m -75.49 138.02 41.3 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 169.39 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -143.5 158.0 44.0 Favored 'General case' 0 C--N 1.334 -0.105 0 C-N-CA 126.244 1.817 . . . . 0.0 111.071 177.442 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.565 HG23 ' H ' ' A' ' 50' ' ' LYS . 4.1 p -152.45 151.21 12.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 168.097 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 34.3 tp -69.38 132.7 46.8 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 127.176 2.19 . . . . 0.0 109.41 173.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -113.51 174.98 5.65 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.973 1.309 . . . . 0.0 109.399 178.053 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.477 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 28.4 mt-10 -64.31 -20.49 66.12 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 125.715 1.606 . . . . 0.0 113.146 -177.386 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -82.0 6.08 17.23 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.416 1.487 . . . . 0.0 111.612 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 68.03 -4.52 1.01 Allowed 'General case' 0 C--O 1.237 0.404 0 C-N-CA 128.874 2.87 . . . . 0.0 113.931 -175.171 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -77.49 168.3 20.23 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 119.378 0.99 . . . . 0.0 111.959 172.615 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.447 ' CZ3' ' HA ' ' A' ' 60' ' ' VAL . 22.2 m95 -107.99 144.02 35.86 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 107.407 -1.331 . . . . 0.0 107.407 166.831 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -134.22 151.73 76.96 Favored Pre-proline 0 C--N 1.331 -0.235 0 C-N-CA 124.557 1.143 . . . . 0.0 111.626 -167.729 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -74.71 146.95 34.62 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 124.026 3.151 . . . . 0.0 112.607 -172.398 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -135.07 36.49 3.03 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.205 1.402 . . . . 0.0 111.927 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 70.99 166.4 0.13 Allowed Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 126.519 1.928 . . . . 0.0 111.896 -177.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.02 176.38 9.99 Favored 'Trans proline' 0 CA--C 1.535 0.543 0 C-N-CA 121.386 1.39 . . . . 0.0 111.269 170.021 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 14.5 tp -120.77 151.35 54.41 Favored Pre-proline 0 CA--C 1.543 0.675 0 C-N-CA 125.17 1.388 . . . . 0.0 110.234 -176.774 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -73.27 163.16 38.66 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.837 2.358 . . . . 0.0 111.171 168.667 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.0 -25.17 23.17 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 122.423 2.082 . . . . 0.0 112.879 179.104 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -83.36 -19.03 36.86 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 119.132 0.878 . . . . 0.0 110.636 176.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.69 -18.2 51.7 Favored Glycine 0 CA--C 1.532 1.111 0 N-CA-C 111.269 -0.733 . . . . 0.0 111.269 171.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 40.3 tp -60.0 -54.06 50.47 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 124.836 1.254 . . . . 0.0 108.429 170.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -62.73 -24.64 67.78 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 125.501 1.521 . . . . 0.0 112.239 179.556 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 -66.91 -45.4 78.06 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 120.393 1.451 . . . . 0.0 109.874 172.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -67.62 -54.98 15.18 Favored 'General case' 0 C--O 1.231 0.111 0 N-CA-C 108.218 -1.031 . . . . 0.0 108.218 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 12.2 mm -55.7 -32.22 30.95 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 125.165 1.386 . . . . 0.0 110.961 -178.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.81 -57.04 4.63 Favored 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 124.259 1.023 . . . . 0.0 111.447 175.325 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -70.5 -34.87 72.82 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 120.341 -0.543 . . . . 0.0 111.58 -170.428 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 28.5 t60 -60.67 -53.16 60.85 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.661 0.784 . . . . 0.0 109.852 175.442 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 99.6 m -63.8 -37.91 89.15 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 118.296 -0.859 . . . . 0.0 110.484 179.52 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.06 -36.49 77.73 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 119.242 0.928 . . . . 0.0 112.402 -179.041 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 13.1 t -70.06 -32.82 71.11 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.886 0.766 . . . . 0.0 110.479 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 63.8 mt -80.03 -56.59 4.14 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.721 0.808 . . . . 0.0 109.682 177.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 135.19 7.83 1.91 Allowed Glycine 0 CA--C 1.539 1.548 0 C-N-CA 126.004 1.764 . . . . 0.0 114.055 -175.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 39.3 m-70 -87.01 170.49 11.52 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 119.956 1.878 . . . . 0.0 110.488 -179.872 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 5.6 m -140.81 -27.75 0.71 Allowed 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 116.153 1.908 . . . . 0.0 116.153 175.628 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -178.58 175.21 1.13 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.304 1.441 . . . . 0.0 111.162 -173.915 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.466 HG23 ' H ' ' A' ' 95' ' ' SER 0.27 12.3 t -142.68 -74.56 0.28 Allowed 'General case' 0 N--CA 1.445 -0.697 0 C-N-CA 125.904 1.682 . . . . 0.0 107.385 179.041 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 95' ' ' SER . . . . . 0.466 ' H ' HG23 ' A' ' 94' ' ' THR . 2.5 p -158.04 -178.48 7.33 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.827 1.251 . . . . 0.0 110.207 -178.111 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.434 ' HE2' ' HB2' ' A' ' 100' ' ' HIS . 43.9 tttt 66.12 17.45 10.76 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 114.377 1.251 . . . . 0.0 114.377 156.781 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 9.7 tmm? 53.4 87.18 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.428 1.891 . . . . 0.0 107.988 -157.485 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 58.8 m80 48.32 -86.16 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 127.383 2.273 . . . . 0.0 112.84 -174.293 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 43.1 mt -148.07 128.89 14.31 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 127.567 2.347 . . . . 0.0 106.309 -160.206 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' HIS . . . . . 0.434 ' HB2' ' HE2' ' A' ' 96' ' ' LYS . 13.9 t60 -66.57 -46.24 76.68 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.924 0.393 . . . . 0.0 110.331 -176.873 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 74.3 m -153.72 174.04 15.05 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.264 1.426 . . . . 0.0 110.292 -171.158 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 38.8 t -50.41 -39.74 17.52 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 C-N-CA 126.799 2.04 . . . . 0.0 109.496 173.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 20.9 tpp -57.1 -40.03 76.22 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 124.186 0.994 . . . . 0.0 113.386 177.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -69.89 -42.1 73.86 Favored 'General case' 0 N--CA 1.463 0.177 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 177.346 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.74 -45.6 91.97 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.785 1.234 . . . . 0.0 112.381 -172.287 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 11.0 mm -58.05 -43.9 86.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -66.85 -46.43 75.1 Favored 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 124.154 0.981 . . . . 0.0 110.411 -178.546 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 36.1 t80 -53.71 -61.48 2.27 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 125.516 1.526 . . . . 0.0 110.063 177.391 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 7.2 mp -50.34 -46.76 55.92 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.154 1.382 . . . . 0.0 112.384 175.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -63.0 -36.77 84.66 Favored 'General case' 0 C--N 1.333 -0.142 0 O-C-N 123.323 0.39 . . . . 0.0 111.591 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -74.86 -26.13 59.46 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 118.542 -0.742 . . . . 0.0 111.584 179.252 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 29.2 mt -63.96 -60.78 2.83 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 124.043 0.937 . . . . 0.0 109.358 -177.331 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 49.37 21.29 0.54 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 127.904 2.481 . . . . 0.0 116.709 176.922 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.661 -1.077 . . . . 0.0 111.625 168.96 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.517 -0.304 0 N-CA-C 106.046 -1.835 . . . . 0.0 106.046 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 134.0 82.1 0.18 Allowed Glycine 0 CA--C 1.521 0.448 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -164.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 45.52 -154.94 0.04 OUTLIER 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.622 1.969 . . . . 0.0 115.11 170.237 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -175.61 -101.94 0.15 Allowed Glycine 0 C--N 1.333 0.39 0 N-CA-C 106.788 -2.525 . . . . 0.0 106.788 175.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -84.63 15.76 3.62 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.64 1.176 . . . . 0.0 111.711 -178.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -113.9 157.28 42.34 Favored Pre-proline 0 N--CA 1.446 -0.627 0 C-N-CA 127.708 2.403 . . . . 0.0 109.924 -176.488 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.24 -55.04 0.07 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.207 0 C-N-CA 121.756 1.637 . . . . 0.0 110.883 177.125 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 19.0 t-80 -150.56 147.41 21.36 Favored Pre-proline 0 CA--C 1.534 0.338 0 C-N-CA 125.732 1.613 . . . . 0.0 107.708 -178.375 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -69.11 -38.62 8.94 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 122.795 2.33 . . . . 0.0 111.885 176.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.29 -17.58 61.86 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 117.901 -1.047 . . . . 0.0 112.255 -176.167 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.9 tt -58.74 122.6 13.93 Favored 'General case' 0 C--N 1.346 0.425 0 CA-C-N 118.692 0.678 . . . . 0.0 109.315 170.789 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 43.6 mm -109.95 117.43 54.66 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.257 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 176.28 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -55.17 152.51 14.88 Favored Pre-proline 0 CA--C 1.534 0.335 0 C-N-CA 123.841 0.856 . . . . 0.0 111.114 174.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -73.38 174.27 51.24 Favored 'Cis proline' 0 CA--C 1.535 0.541 0 C-N-CA 125.204 -0.749 . . . . 0.0 112.792 -0.382 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -138.55 173.06 11.99 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 121.234 0.54 . . . . 0.0 111.887 177.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.423 HD22 HD12 ' A' ' 25' ' ' LEU . 18.8 mt -139.78 110.38 6.71 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 126.014 1.725 . . . . 0.0 109.301 -175.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.8 tp -87.2 150.81 23.68 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.365 1.066 . . . . 0.0 108.303 167.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.13 84.84 2.06 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 119.895 1.225 . . . . 0.0 108.621 170.241 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -52.41 134.15 34.63 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 122.815 0.446 . . . . 0.0 111.273 -168.84 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -64.27 125.94 26.18 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.13 -0.941 . . . . 0.0 108.909 -168.522 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 98.29 -19.99 52.29 Favored Glycine 0 CA--C 1.527 0.815 0 CA-C-O 118.241 -1.311 . . . . 0.0 112.168 -178.405 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 2.3 t -88.85 -177.09 5.42 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 119.423 1.612 . . . . 0.0 109.989 174.263 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.1 m-80 -127.66 -12.66 5.44 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 124.644 1.178 . . . . 0.0 110.105 170.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -76.13 126.73 31.53 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 -176.248 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.511 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 3.5 mm? -75.51 147.32 39.85 Favored 'General case' 0 CA--C 1.52 -0.207 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 168.479 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -108.6 87.26 4.17 Favored Pre-proline 0 CA--C 1.537 0.453 0 C-N-CA 126.309 1.844 . . . . 0.0 109.081 175.057 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -66.32 113.09 2.53 Favored 'Trans proline' 0 N--CA 1.46 -0.496 0 C-N-CA 123.499 2.799 . . . . 0.0 109.901 177.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.2 mt -112.18 107.84 16.87 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 -177.812 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -51.65 -47.77 63.62 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 126.478 1.911 . . . . 0.0 111.587 -176.33 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.3 t -163.91 -179.25 6.16 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-O 121.949 0.88 . . . . 0.0 108.721 -168.44 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -68.33 -21.94 64.72 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 115.106 -0.952 . . . . 0.0 112.387 -175.384 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -69.85 -35.39 74.69 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 123.631 0.772 . . . . 0.0 110.626 169.224 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.8 t0 -67.03 -41.32 86.81 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 123.661 0.784 . . . . 0.0 109.423 177.673 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 75.5 t-105 -54.01 -41.06 67.57 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 121.536 -0.727 . . . . 0.0 111.193 172.684 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -71.91 -37.13 70.13 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 118.466 -0.778 . . . . 0.0 111.574 176.792 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.03 -50.29 74.65 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 119.485 1.039 . . . . 0.0 109.972 172.483 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -51.7 -57.03 10.37 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 119.289 0.95 . . . . 0.0 111.265 -173.21 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 25.7 p -67.24 -22.31 65.7 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.605 -0.725 . . . . 0.0 112.015 -175.204 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -77.81 -48.61 16.12 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.292 1.037 . . . . 0.0 112.832 171.787 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -102.01 -16.67 16.39 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.217 1.192 . . . . 0.0 114.217 -153.363 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 64.0 p -139.64 -32.3 0.64 Allowed 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 125.882 1.673 . . . . 0.0 111.291 -178.814 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.9 ttmt 70.29 -50.59 0.65 Allowed 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 129.799 3.24 . . . . 0.0 114.071 174.679 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER 45.13 21.68 0.06 Allowed 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 127.706 2.402 . . . . 0.0 115.309 172.265 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.556 HD12 ' N ' ' A' ' 44' ' ' LEU . 2.5 mp 50.45 -177.09 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 127.182 2.193 . . . . 0.0 112.822 -172.772 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.1 mt -141.3 131.85 25.45 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 165.256 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -140.33 163.06 33.79 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.315 1.046 . . . . 0.0 110.987 -174.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -76.19 70.92 2.88 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.622 1.169 . . . . 0.0 110.959 -171.32 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 152.03 18.18 0.06 OUTLIER Glycine 0 CA--C 1.524 0.6 0 CA-C-O 118.908 -0.94 . . . . 0.0 114.433 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -71.22 -17.04 62.53 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.305 1.442 . . . . 0.0 113.437 179.208 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 52.25 154.91 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 129.869 3.267 . . . . 0.0 113.454 -174.302 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.7 tp -136.73 151.62 49.43 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 106.156 -1.794 . . . . 0.0 106.156 169.153 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 39.8 t -134.46 141.03 44.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 105.359 -2.089 . . . . 0.0 105.359 163.549 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -106.15 -178.67 3.72 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.077 1.351 . . . . 0.0 111.422 176.354 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.3 t -58.75 -24.39 61.55 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.271 1.428 . . . . 0.0 112.62 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 27.4 m120 -90.23 1.04 56.9 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 124.498 1.119 . . . . 0.0 111.618 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 65.93 24.05 11.22 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.519 1.128 . . . . 0.0 111.254 -173.69 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 24.3 m170 -69.11 108.52 3.61 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 164.195 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 92.8 m -70.81 153.35 42.83 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 121.702 0.763 . . . . 0.0 109.055 164.558 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -142.86 156.33 44.91 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.334 1.454 . . . . 0.0 108.157 170.103 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 25.7 t -135.19 144.69 33.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 C-N-CA 125.667 1.587 . . . . 0.0 107.78 166.623 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 11.9 tp -75.29 129.76 37.95 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 128.859 2.864 . . . . 0.0 106.872 175.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -120.91 170.55 9.38 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -178.197 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -61.09 -23.52 65.55 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 123.762 0.825 . . . . 0.0 112.161 -175.457 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -74.97 4.14 7.11 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.613 1.565 . . . . 0.0 112.341 176.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 58.56 21.77 9.01 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 128.419 2.687 . . . . 0.0 113.517 175.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.6 p80 -101.65 170.54 8.11 Favored 'General case' 0 C--O 1.232 0.17 0 C-N-CA 123.971 0.908 . . . . 0.0 110.259 163.285 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 62.2 m95 -103.16 95.47 6.14 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 171.058 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 60.5 t60 -69.13 144.51 95.38 Favored Pre-proline 0 CA--C 1.54 0.572 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 178.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -69.82 106.48 1.68 Allowed 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 123.788 2.992 . . . . 0.0 111.386 178.692 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -81.51 37.28 0.45 Allowed 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.59 1.556 . . . . 0.0 111.895 -177.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 69.79 165.05 0.13 Allowed Pre-proline 0 CA--C 1.541 0.611 0 C-N-CA 128.364 2.666 . . . . 0.0 112.751 -173.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -74.44 168.23 25.3 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 121.336 1.357 . . . . 0.0 110.06 166.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 21.6 tp -121.33 144.3 39.6 Favored Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 124.622 1.169 . . . . 0.0 108.817 -176.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.89 167.48 27.11 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.708 2.272 . . . . 0.0 110.76 172.236 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -66.46 -35.09 31.78 Favored 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 120.791 0.994 . . . . 0.0 111.491 -175.392 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -67.48 -27.11 66.74 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.886 1.274 . . . . 0.0 110.731 174.119 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -69.49 -29.61 71.5 Favored Glycine 0 N--CA 1.444 -0.788 0 CA-C-O 119.351 -0.694 . . . . 0.0 111.655 -173.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 21.1 tp -51.52 -47.42 63.33 Favored 'General case' 0 C--N 1.342 0.251 0 CA-C-N 117.683 0.741 . . . . 0.0 110.158 170.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -58.62 -30.64 67.42 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-O 117.259 -1.353 . . . . 0.0 111.384 -173.264 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 60.8 m-20 -57.68 -37.06 72.8 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 120.302 1.41 . . . . 0.0 111.279 176.625 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -71.42 -62.14 1.52 Allowed 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 -178.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.429 HD12 HD11 ' A' ' 109' ' ' LEU . 15.9 mm -59.47 -28.12 38.99 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 122.991 0.517 . . . . 0.0 111.671 -174.25 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.5 mtm180 -48.65 -40.59 28.44 Favored 'General case' 0 C--N 1.338 0.096 0 C-N-CA 124.924 1.29 . . . . 0.0 111.619 171.071 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.48 -61.41 2.46 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.446 1.098 . . . . 0.0 110.441 177.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.511 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 7.9 t60 -52.32 -43.89 64.8 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 125.514 1.526 . . . . 0.0 110.015 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 93.8 m -68.48 -43.62 76.56 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 121.588 -0.695 . . . . 0.0 111.86 179.382 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.11 -39.18 92.74 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 118.812 0.733 . . . . 0.0 111.246 -174.737 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 12.4 t -69.33 -11.74 61.07 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 118.189 -0.91 . . . . 0.0 111.791 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 67.2 mt -125.78 -4.44 7.03 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.71 1.604 . . . . 0.0 113.231 -176.04 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 73.75 20.91 79.8 Favored Glycine 0 CA--C 1.536 1.402 0 O-C-N 120.403 -1.436 . . . . 0.0 114.501 -178.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' HIS . . . . . 0.514 ' NE2' HD13 ' A' ' 112' ' ' LEU . 10.1 m-70 -63.83 161.65 15.02 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-N 119.951 1.876 . . . . 0.0 112.476 -172.67 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 84.4 m -81.07 -173.68 4.43 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.882 2.073 . . . . 0.0 112.921 177.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 5.4 t -152.78 139.37 18.74 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 127.196 2.199 . . . . 0.0 107.739 172.42 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 10.8 t -154.99 -164.55 1.82 Allowed 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.901 1.68 . . . . 0.0 109.102 -172.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 3.8 t 54.11 32.31 15.51 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 127.576 2.35 . . . . 0.0 116.911 154.528 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt 68.45 113.51 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 126.247 1.819 . . . . 0.0 110.361 -174.588 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 10.9 ttp 52.47 44.35 30.05 Favored 'General case' 0 CA--C 1.52 -0.192 0 C-N-CA 125.597 1.559 . . . . 0.0 111.852 170.502 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 63.73 -85.28 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.656 1.582 . . . . 0.0 107.74 -176.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -111.24 115.25 29.03 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 126.583 1.953 . . . . 0.0 109.388 172.514 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 10.7 t-160 -58.65 -28.99 66.21 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 172.314 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 18.6 m -148.86 165.15 32.37 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.458 -0.776 . . . . 0.0 110.229 -172.023 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 40.6 t -63.11 -35.72 72.94 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 O-C-N 121.65 -0.657 . . . . 0.0 109.873 179.314 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -40.65 88.54 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 126.495 1.918 . . . . 0.0 111.233 175.464 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.59 -51.02 71.19 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 178.655 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.12 -50.91 71.82 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.057 1.343 . . . . 0.0 112.794 -176.742 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 33.9 mm -55.87 -47.92 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 CA-C-N 119.938 1.245 . . . . 0.0 109.041 -175.358 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -69.66 -40.76 76.24 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 123.954 0.902 . . . . 0.0 110.105 -172.155 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.69 ' CE2' HD11 ' A' ' 112' ' ' LEU . 73.8 t80 -52.17 -67.08 0.28 Allowed 'General case' 0 C--O 1.224 -0.237 0 C-N-CA 125.224 1.41 . . . . 0.0 109.633 171.606 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.666 ' HA ' HD12 ' A' ' 112' ' ' LEU . 7.7 mp -45.45 -45.97 13.26 Favored 'General case' 0 C--N 1.345 0.383 0 C-N-CA 124.498 1.119 . . . . 0.0 112.08 175.027 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -62.64 -39.92 95.38 Favored 'General case' 0 C--N 1.334 -0.079 0 CA-C-O 119.207 -0.425 . . . . 0.0 112.031 -178.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -85.7 -11.25 54.18 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 118.531 0.605 . . . . 0.0 112.497 -176.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.69 HD11 ' CE2' ' A' ' 108' ' ' PHE . 45.4 mt -71.61 -38.09 70.85 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 118.932 0.787 . . . . 0.0 110.082 173.955 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -59.54 163.8 3.92 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.549 1.54 . . . . 0.0 109.766 173.216 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.664 0 CA-C-O 118.366 -1.241 . . . . 0.0 111.44 179.19 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.3 ttm . . . . . 0 N--CA 1.472 0.65 0 CA-C-O 117.413 -1.28 . . . . 0.0 111.793 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 155.12 81.78 0.03 OUTLIER Glycine 0 C--N 1.34 0.792 0 CA-C-N 120.689 1.586 . . . . 0.0 112.749 172.089 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 59.62 -168.8 0.15 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.421 1.488 . . . . 0.0 112.04 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 148.07 172.18 17.79 Favored Glycine 0 CA--C 1.528 0.852 0 C-N-CA 124.278 0.942 . . . . 0.0 111.632 177.634 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -83.06 16.67 2.25 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.441 -1.035 . . . . 0.0 111.589 -174.23 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.83 160.83 42.54 Favored Pre-proline 0 CA--C 1.542 0.651 0 C-N-CA 126.027 1.731 . . . . 0.0 111.558 176.403 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -83.6 80.3 2.54 Favored 'Trans proline' 0 N--CA 1.448 -1.179 0 C-N-CA 122.837 2.358 . . . . 0.0 109.204 -175.423 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 75.33 149.69 0.13 Allowed Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 127.12 2.168 . . . . 0.0 110.917 -176.28 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -93.26 -18.77 0.56 Allowed 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 122.751 2.3 . . . . 0.0 112.572 174.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.83 -18.58 65.45 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 119.162 0.892 . . . . 0.0 110.37 169.725 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 tt -67.58 132.01 46.73 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.321 0.648 . . . . 0.0 110.683 169.603 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 40.1 mm -120.87 99.97 8.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 C-N-CA 126.822 2.049 . . . . 0.0 108.398 -174.576 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -50.06 151.16 3.63 Favored Pre-proline 0 C--O 1.235 0.335 0 C-N-CA 124.059 0.944 . . . . 0.0 112.621 179.473 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -70.48 165.49 78.56 Favored 'Cis proline' 0 CA--C 1.532 0.387 0 O-C-N 122.982 0.99 . . . . 0.0 112.754 1.524 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.463 ' HB1' HD12 ' A' ' 51' ' ' LEU . . . -140.11 172.11 13.23 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.328 0.585 . . . . 0.0 111.809 176.826 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 14.7 mt -140.36 105.83 5.08 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 127.072 2.149 . . . . 0.0 107.498 -171.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 25.9 tp -77.72 152.85 33.47 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 167.791 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.19 84.75 1.71 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.959 1.254 . . . . 0.0 113.426 176.343 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -44.89 144.59 1.14 Allowed 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 116.012 1.856 . . . . 0.0 116.012 -166.736 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -76.67 85.63 3.32 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 124.981 1.312 . . . . 0.0 109.681 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 138.21 -34.85 2.09 Favored Glycine 0 CA--C 1.524 0.643 0 C-N-CA 126.426 1.965 . . . . 0.0 110.988 175.03 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -83.38 -20.68 33.78 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 118.371 -0.823 . . . . 0.0 113.092 -163.187 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 12.8 m-80 71.64 -21.43 0.21 Allowed 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 126.811 2.044 . . . . 0.0 112.511 -179.124 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -65.47 150.38 48.45 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 125.791 1.636 . . . . 0.0 111.56 173.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.2 mt -107.22 153.47 22.64 Favored 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 126.141 1.776 . . . . 0.0 109.013 171.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -118.57 86.87 30.07 Favored Pre-proline 0 CA--C 1.537 0.447 0 C-N-CA 124.992 1.317 . . . . 0.0 109.557 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -65.08 128.18 20.06 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 123.483 2.788 . . . . 0.0 110.338 178.126 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.2 mt -134.36 113.93 12.42 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 -177.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 4.1 mtt85 -64.64 -46.71 81.38 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.849 0.86 . . . . 0.0 112.419 -169.351 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.551 ' H ' ' HB2' ' A' ' 33' ' ' ASP . 43.1 p -141.48 -179.92 6.43 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.931 1.293 . . . . 0.0 109.738 -178.432 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -53.62 -36.36 61.92 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 123.705 0.802 . . . . 0.0 110.752 167.79 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -65.98 -30.22 70.74 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 123.241 0.616 . . . . 0.0 110.84 -179.715 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.551 ' HB2' ' H ' ' A' ' 30' ' ' THR . 0.3 OUTLIER -70.79 -41.22 71.93 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 123.621 0.769 . . . . 0.0 109.892 174.961 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 67.6 t-105 -60.72 -42.82 98.03 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 110.5 -0.185 . . . . 0.0 110.5 173.44 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -59.42 -38.37 80.47 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 121.175 -0.953 . . . . 0.0 110.982 174.79 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.62 -18.3 63.77 Favored 'General case' 0 C--O 1.227 -0.098 0 C-N-CA 125.599 1.56 . . . . 0.0 112.826 176.894 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -73.33 -66.49 0.68 Allowed 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 178.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 11.4 p -60.89 -28.15 68.69 Favored 'General case' 0 C--O 1.234 0.267 0 O-C-N 121.157 -0.965 . . . . 0.0 112.885 -178.395 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -78.35 -11.55 59.95 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 117.698 -1.144 . . . . 0.0 112.273 177.478 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -143.33 84.34 1.81 Allowed 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 119.822 1.192 . . . . 0.0 110.027 -174.515 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 75.31 110.43 0.07 Allowed 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 128.14 2.576 . . . . 0.0 109.719 -171.16 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.8 mttt -75.87 65.52 1.98 Allowed 'General case' 0 C--O 1.235 0.339 0 O-C-N 120.762 -1.211 . . . . 0.0 108.457 174.021 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.4 t-160 -48.44 134.65 15.01 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 124.493 1.117 . . . . 0.0 108.253 175.088 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.5 mp -49.64 147.96 3.23 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 123.463 0.705 . . . . 0.0 110.269 175.327 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 19.9 mt -133.1 126.47 31.84 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 177.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -108.85 149.1 29.6 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 126.482 1.913 . . . . 0.0 108.048 -179.601 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.657 ' HA ' HD13 ' A' ' 61' ' ' LEU . 57.9 m-85 -71.73 153.51 41.96 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 176.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.15 16.95 73.48 Favored Glycine 0 CA--C 1.531 1.067 0 CA-C-O 119.509 -0.606 . . . . 0.0 114.087 -173.71 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -59.65 -25.46 64.72 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.09 1.445 . . . . 0.0 113.283 175.264 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.7 ttmt 69.75 142.29 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 127.759 2.423 . . . . 0.0 111.006 -175.218 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.463 HD12 ' HB1' ' A' ' 15' ' ' ALA . 0.2 OUTLIER -123.68 146.81 47.96 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 105.497 -2.038 . . . . 0.0 105.497 165.348 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 72.5 t -135.28 143.71 36.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 106.343 -1.725 . . . . 0.0 106.343 170.316 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -125.3 -179.13 4.46 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.03 1.732 . . . . 0.0 111.627 -177.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.41 -19.49 65.96 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.977 1.102 . . . . 0.0 113.977 179.109 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -85.69 0.18 53.45 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 118.869 0.759 . . . . 0.0 111.065 175.188 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 54.78 31.7 16.07 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 126.16 1.784 . . . . 0.0 110.107 -168.293 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 29.6 m170 -71.23 115.21 10.11 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 120.248 -1.533 . . . . 0.0 107.151 166.276 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.2 m -77.03 147.51 36.72 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 167.186 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -135.92 159.7 40.87 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 125.014 1.325 . . . . 0.0 108.125 169.494 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 27.2 t -137.84 135.13 45.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 C-N-CA 129.061 2.944 . . . . 0.0 106.333 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.657 HD13 ' HA ' ' A' ' 47' ' ' TYR . 0.4 OUTLIER -78.27 140.02 38.87 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 175.127 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -113.49 161.16 17.69 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 123.259 0.624 . . . . 0.0 109.824 175.016 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.408 ' HA ' ' CZ ' ' A' ' 47' ' ' TYR . 2.8 mt-10 -53.15 -25.61 14.03 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.655 0.782 . . . . 0.0 112.528 -177.914 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.83 -12.15 2.87 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 129.404 3.082 . . . . 0.0 114.041 172.192 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 63.69 36.73 10.55 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-N 120.423 1.465 . . . . 0.0 110.851 -174.637 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -124.3 173.57 8.29 Favored 'General case' 0 N--CA 1.457 -0.099 0 C-N-CA 125.072 1.349 . . . . 0.0 111.161 164.375 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 70.7 m95 -115.89 121.28 41.86 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 125.074 1.35 . . . . 0.0 107.87 177.437 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -95.34 155.79 38.39 Favored Pre-proline 0 N--CA 1.439 -0.981 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 179.035 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -66.53 121.36 8.6 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 123.084 2.523 . . . . 0.0 109.094 170.64 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -108.23 40.53 1.74 Allowed 'General case' 0 C--O 1.236 0.35 0 C-N-CA 124.747 1.219 . . . . 0.0 109.987 -177.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.85 165.91 0.13 Allowed Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 127.136 2.174 . . . . 0.0 112.682 179.63 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -71.79 178.0 6.3 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 121.567 1.511 . . . . 0.0 111.007 166.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 15.7 tp -142.65 145.06 32.6 Favored Pre-proline 0 CA--C 1.535 0.369 0 C-N-CA 124.083 0.953 . . . . 0.0 111.648 -169.531 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -67.81 165.88 26.29 Favored 'Trans proline' 0 CA--C 1.536 0.617 0 C-N-CA 122.619 2.213 . . . . 0.0 113.039 176.391 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -61.77 -22.5 74.51 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 123.688 2.925 . . . . 0.0 113.257 173.795 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -86.36 -16.37 37.59 Favored 'General case' 0 C--N 1.332 -0.179 0 O-C-N 121.304 -0.872 . . . . 0.0 112.25 176.537 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -67.55 -32.89 79.78 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 120.537 -0.839 . . . . 0.0 111.958 179.326 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 35.8 tp -53.97 -58.62 6.63 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 118.054 0.927 . . . . 0.0 108.581 168.227 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -46.14 -37.69 7.27 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 126.52 1.928 . . . . 0.0 113.502 178.717 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -70.86 -37.21 73.08 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 124.583 1.153 . . . . 0.0 112.005 -177.518 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.2 tp -70.37 -51.45 29.72 Favored 'General case' 0 CA--C 1.521 -0.15 0 C-N-CA 124.866 1.266 . . . . 0.0 110.964 175.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 27.6 mm -57.47 -35.54 50.07 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 -177.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -46.22 -39.22 9.48 Favored 'General case' 0 C--O 1.224 -0.253 0 C-N-CA 124.798 1.239 . . . . 0.0 112.988 173.231 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.97 -62.27 1.98 Allowed 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 123.718 0.807 . . . . 0.0 109.599 178.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 42.8 t60 -57.7 -39.14 76.52 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.151 0.98 . . . . 0.0 110.723 -177.463 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 66.0 m -64.88 -41.12 95.89 Favored 'General case' 0 N--CA 1.448 -0.527 0 O-C-N 121.438 -0.789 . . . . 0.0 111.788 176.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.33 -38.27 81.37 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 124.493 1.117 . . . . 0.0 112.302 179.402 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.2 t -64.44 -40.56 95.98 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 118.895 0.77 . . . . 0.0 109.809 178.644 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 85.2 mt -82.11 -72.35 0.44 Allowed 'General case' 0 C--O 1.233 0.227 0 C-N-CA 123.819 0.848 . . . . 0.0 108.789 -176.108 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 143.61 42.19 0.06 OUTLIER Glycine 0 CA--C 1.525 0.7 0 C-N-CA 124.761 1.172 . . . . 0.0 111.212 -177.287 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 70.8 m-70 -124.52 177.57 5.86 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 124.136 0.974 . . . . 0.0 111.347 -174.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 28.5 t -145.34 -55.71 0.31 Allowed 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 123.162 1.458 . . . . 0.0 110.191 166.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 7.9 p -146.94 -177.15 5.5 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.931 -172.395 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 2.4 t -150.6 -42.07 0.13 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-O 118.684 -0.674 . . . . 0.0 109.416 177.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 9.2 t -131.97 -52.4 0.98 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-N 118.987 0.812 . . . . 0.0 112.423 -168.01 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 17.3 ptmt -147.39 97.34 2.84 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 119.684 1.129 . . . . 0.0 110.987 -174.111 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 5.3 tmm? 51.0 -157.75 0.1 Allowed 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 -171.409 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.08 -67.1 0.28 Allowed 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 171.706 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.634 HD13 ' HB2' ' A' ' 105' ' ' ALA . 97.1 mt -149.41 153.25 37.07 Favored 'General case' 0 CA--C 1.511 -0.522 0 C-N-CA 126.476 1.91 . . . . 0.0 109.279 -174.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 26.2 t-80 -76.32 -47.09 24.77 Favored 'General case' 0 N--CA 1.444 -0.728 0 C-N-CA 124.407 1.083 . . . . 0.0 112.018 167.395 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 53.9 m -170.14 179.11 3.62 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 125.461 1.504 . . . . 0.0 111.154 -171.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 63.8 t -66.47 -42.97 91.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 CA-C-N 119.602 1.092 . . . . 0.0 111.089 -174.875 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 4.4 tpt -56.83 -46.77 81.48 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 118.714 0.688 . . . . 0.0 109.405 -179.602 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -58.53 -36.84 74.48 Favored 'General case' 0 C--N 1.339 0.147 0 C-N-CA 124.143 0.977 . . . . 0.0 110.194 177.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.634 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -64.62 -45.73 85.63 Favored 'General case' 0 C--O 1.227 -0.131 0 C-N-CA 123.418 0.687 . . . . 0.0 111.929 178.576 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 30.1 mm -59.03 -47.78 88.82 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 -177.019 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -75.82 -32.04 59.65 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 118.834 -0.603 . . . . 0.0 111.31 -177.328 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -60.18 -56.4 22.02 Favored 'General case' 0 C--N 1.342 0.25 0 C-N-CA 123.922 0.889 . . . . 0.0 110.202 173.577 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 25.3 mt -57.6 -43.25 84.55 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -175.512 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -68.86 -7.69 36.87 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 175.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -107.03 -7.95 16.74 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 119.817 1.19 . . . . 0.0 112.601 176.222 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . 0.293 1.3 tp -98.13 -46.56 5.81 Favored 'General case' 0 N--CA 1.416 -2.151 0 C-N-CA 126.472 1.909 . . . . 0.0 109.063 -177.875 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.44 158.7 5.45 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 124.747 1.219 . . . . 0.0 113.805 -156.456 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.242 0 CA-C-O 118.016 -1.435 . . . . 0.0 110.453 171.702 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 42.0 mmm . . . . . 0 N--CA 1.472 0.63 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 133.44 88.48 0.35 Allowed Glycine 0 C--N 1.338 0.671 0 N-CA-C 110.914 -0.875 . . . . 0.0 110.914 172.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -98.44 97.72 9.02 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.758 0.823 . . . . 0.0 110.142 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -172.88 -27.17 0.02 OUTLIER Glycine 0 CA--C 1.525 0.715 0 CA-C-O 119.516 -0.602 . . . . 0.0 113.346 171.549 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -117.49 15.32 14.67 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 125.338 1.455 . . . . 0.0 110.111 177.311 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 6.8 p -130.55 153.68 81.5 Favored Pre-proline 0 C--O 1.239 0.518 0 C-N-CA 125.517 1.527 . . . . 0.0 110.572 -162.669 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -68.18 -55.37 0.25 Allowed 'Trans proline' 0 N--CA 1.45 -1.081 0 C-N-CA 121.699 1.599 . . . . 0.0 110.842 169.432 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -140.45 153.88 68.91 Favored Pre-proline 0 CA--C 1.542 0.65 0 C-N-CA 126.949 2.1 . . . . 0.0 108.481 177.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -85.25 -17.94 4.32 Favored 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 122.75 2.3 . . . . 0.0 113.513 173.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -78.82 -17.61 55.41 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 118.905 0.775 . . . . 0.0 112.278 -179.054 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.405 HD12 ' HB3' ' A' ' 53' ' ' ASP . 0.6 OUTLIER -66.99 135.22 53.42 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.455 0.702 . . . . 0.0 111.013 165.224 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 47.9 mm -123.07 108.02 20.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 C-N-CA 127.27 2.228 . . . . 0.0 106.892 176.483 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 56.6 m95 -52.6 151.99 7.19 Favored Pre-proline 0 C--O 1.238 0.473 0 C-N-CA 124.68 1.192 . . . . 0.0 111.644 -179.215 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -69.69 169.44 63.06 Favored 'Cis proline' 0 N--CA 1.457 -0.658 0 N-CA-C 115.411 1.274 . . . . 0.0 115.411 -0.371 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.78 171.23 14.71 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.596 1.159 . . . . 0.0 111.392 -175.152 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -146.53 102.78 3.61 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.514 1.125 . . . . 0.0 111.04 -165.303 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.9 tp -78.32 150.32 33.3 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 123.35 0.66 . . . . 0.0 109.23 177.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.401 ' O ' ' HE2' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -150.7 84.98 1.36 Allowed 'General case' 0 C--O 1.237 0.416 0 CA-C-N 119.082 0.855 . . . . 0.0 110.574 174.404 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -59.76 158.59 10.11 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 123.565 0.746 . . . . 0.0 110.762 -167.581 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -67.22 125.33 25.72 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 122.836 1.303 . . . . 0.0 111.135 178.288 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 85.75 -31.96 3.82 Favored Glycine 0 CA--C 1.528 0.871 0 C-N-CA 125.692 1.615 . . . . 0.0 111.904 178.534 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 39.4 m -68.14 169.19 10.7 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 118.448 1.124 . . . . 0.0 110.077 170.609 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -141.1 -16.4 0.85 Allowed 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 125.265 1.426 . . . . 0.0 111.958 -175.021 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -71.03 105.94 3.51 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 175.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.474 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 3.9 mm? -60.37 137.86 58.07 Favored 'General case' 0 N--CA 1.462 0.162 0 N-CA-C 106.903 -1.518 . . . . 0.0 106.903 171.498 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.56 88.12 8.9 Favored Pre-proline 0 C--N 1.33 -0.261 0 C-N-CA 125.308 1.443 . . . . 0.0 107.864 -174.648 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -62.54 132.06 36.39 Favored 'Trans proline' 0 CA--C 1.541 0.829 0 C-N-CA 123.208 2.605 . . . . 0.0 109.994 176.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -119.4 118.05 30.13 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 106.105 -1.813 . . . . 0.0 106.105 168.768 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 72.7 mtm180 -75.03 -47.02 31.11 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 -174.237 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 67.4 p -135.59 178.59 6.92 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.815 0.846 . . . . 0.0 110.903 -179.258 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -60.03 -39.5 86.12 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.452 -0.78 . . . . 0.0 109.582 175.387 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -56.66 -23.81 44.17 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.459 1.104 . . . . 0.0 111.371 176.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -93.86 -32.51 13.9 Favored 'General case' 0 N--CA 1.454 -0.272 0 O-C-N 120.756 -1.215 . . . . 0.0 111.058 -172.905 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 11.0 t-105 -58.06 -42.83 86.3 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 165.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -53.53 -60.29 3.5 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 172.432 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.467 ' HA ' ' HB3' ' A' ' 39' ' ' ALA . 0.0 OUTLIER -71.42 -25.78 62.48 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 117.556 -1.658 . . . . 0.0 110.204 -163.546 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 31.2 t80 -53.63 -51.01 64.45 Favored 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 123.23 0.612 . . . . 0.0 110.022 175.631 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 31.6 p -93.71 -5.63 48.05 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -174.589 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.467 ' HB3' ' HA ' ' A' ' 36' ' ' ARG . . . -71.51 -5.18 31.25 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 127.832 2.453 . . . . 0.0 112.488 163.684 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -145.49 116.1 7.66 Favored 'General case' 0 N--CA 1.436 -1.163 0 N-CA-C 104.484 -2.414 . . . . 0.0 104.484 -165.494 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.0 t -49.06 95.18 0.01 OUTLIER 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 126.611 1.964 . . . . 0.0 109.956 178.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.2 mmtp -132.04 -76.77 0.51 Allowed 'General case' 0 CA--C 1.518 -0.255 0 C-N-CA 125.38 1.472 . . . . 0.0 107.702 -173.2 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -138.09 160.08 40.33 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 -172.462 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.555 HD22 ' H ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -111.18 122.37 47.71 Favored 'General case' 0 CA--C 1.513 -0.451 0 C-N-CA 125.146 1.378 . . . . 0.0 108.985 -160.723 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 48.5 mt -75.48 128.54 35.55 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.693 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -142.78 163.61 32.34 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 125.941 1.696 . . . . 0.0 107.54 -178.012 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.481 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 20.6 m-85 -55.95 138.23 49.2 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.77 0.795 . . . . 0.0 110.67 -179.108 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.28 7.69 76.15 Favored Glycine 0 CA--C 1.536 1.384 0 CA-C-O 118.096 -1.391 . . . . 0.0 114.244 179.181 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.97 -27.17 61.02 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 119.716 1.758 . . . . 0.0 115.483 -170.487 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.476 ' H ' HG23 ' A' ' 60' ' ' VAL . 22.0 ttmt 57.62 152.2 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 130.38 3.472 . . . . 0.0 115.791 174.847 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.4 tp -141.19 155.58 46.04 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 174.739 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 97.0 t -130.58 155.43 41.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 105.105 -2.183 . . . . 0.0 105.105 157.677 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.405 ' HB3' HD12 ' A' ' 11' ' ' LEU . 2.0 p-10 -123.5 -179.74 4.45 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 126.521 1.928 . . . . 0.0 111.76 176.512 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.5 m -68.55 -17.12 64.08 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 114.857 1.428 . . . . 0.0 114.857 177.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -77.36 -7.81 56.68 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 120.433 1.469 . . . . 0.0 111.27 168.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 64.66 32.28 11.44 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.885 1.274 . . . . 0.0 110.713 -167.328 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 54.1 m170 -83.61 110.3 18.13 Favored 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 166.398 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.5 m -79.67 149.18 31.33 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 169.78 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -146.64 164.81 31.49 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 125.448 1.499 . . . . 0.0 110.623 176.385 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.476 HG23 ' H ' ' A' ' 50' ' ' LYS . 7.6 p -153.72 150.89 11.97 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 CA-C-N 120.372 1.442 . . . . 0.0 113.871 170.028 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.433 HD12 ' O ' ' A' ' 66' ' ' HIS . 38.6 tp -72.19 135.62 46.17 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.744 2.017 . . . . 0.0 109.301 176.34 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -116.25 -179.74 3.76 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.313 1.045 . . . . 0.0 109.27 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.481 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 14.7 mp0 -60.32 -20.96 61.34 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.885 1.274 . . . . 0.0 113.826 -177.305 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -90.91 16.44 9.45 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.416 1.086 . . . . 0.0 112.552 -173.277 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 61.38 -0.57 0.36 Allowed 'General case' 0 C--O 1.239 0.547 0 C-N-CA 126.855 2.062 . . . . 0.0 114.075 -172.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.433 ' O ' HD12 ' A' ' 61' ' ' LEU . 0.9 OUTLIER -82.29 171.99 13.62 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 118.864 0.756 . . . . 0.0 111.164 176.379 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.416 ' CE2' ' HB2' ' A' ' 61' ' ' LEU . 26.2 m95 -115.57 147.14 41.07 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 168.748 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -134.55 162.87 55.13 Favored Pre-proline 0 CA--C 1.532 0.256 0 C-N-CA 125.272 1.429 . . . . 0.0 111.272 -169.013 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -72.19 133.15 20.68 Favored 'Trans proline' 0 CA--C 1.535 0.548 0 C-N-CA 123.5 2.8 . . . . 0.0 112.587 -176.421 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -114.46 29.52 7.96 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.999 1.32 . . . . 0.0 111.432 175.099 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 70.05 165.35 0.13 Allowed Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 127.615 2.366 . . . . 0.0 111.899 -178.242 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -70.43 173.01 12.2 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 121.207 1.271 . . . . 0.0 110.259 168.71 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 12.6 tp -127.19 144.29 50.09 Favored Pre-proline 0 CA--C 1.533 0.322 0 CA-C-O 117.755 -1.117 . . . . 0.0 108.569 -178.698 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -76.02 169.36 22.27 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 122.761 2.307 . . . . 0.0 110.19 173.515 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -63.02 -30.31 76.15 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 121.889 1.726 . . . . 0.0 112.918 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -82.1 -21.52 36.71 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 119.385 0.993 . . . . 0.0 111.459 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.22 -16.28 57.72 Favored Glycine 0 CA--C 1.534 1.247 0 O-C-N 121.872 -0.518 . . . . 0.0 112.457 178.598 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 23.8 tp -61.04 -52.55 64.51 Favored 'General case' 0 C--O 1.232 0.148 0 C-N-CA 126.133 1.773 . . . . 0.0 109.592 172.843 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -71.65 -34.13 69.49 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 125.306 1.442 . . . . 0.0 109.088 -169.805 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -52.57 -48.44 66.19 Favored 'General case' 0 CA--C 1.516 -0.333 0 C-N-CA 126.185 1.794 . . . . 0.0 112.081 172.169 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 28.9 mt -65.01 -58.2 6.72 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.416 177.846 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.486 HD12 HD11 ' A' ' 109' ' ' LEU . 16.4 mm -58.86 -25.0 27.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.339 0 CA-C-O 118.952 -0.546 . . . . 0.0 111.984 -175.579 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 5.7 ttm180 -46.32 -40.37 11.67 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-O 117.909 -1.043 . . . . 0.0 111.523 173.104 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -67.29 -45.85 75.32 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 119.385 0.993 . . . . 0.0 112.041 -178.671 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.474 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 10.9 t60 -61.96 -45.43 93.68 Favored 'General case' 0 C--O 1.223 -0.3 0 C-N-CA 124.473 1.109 . . . . 0.0 109.318 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 99.1 m -69.42 -46.11 67.59 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 121.548 -0.72 . . . . 0.0 110.657 -179.137 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.23 -44.72 95.91 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 118.392 -0.813 . . . . 0.0 110.861 -177.263 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 8.4 t -67.25 -17.86 64.97 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 117.986 -1.007 . . . . 0.0 112.181 -175.198 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 83.7 mt -110.64 -35.31 6.04 Favored 'General case' 0 C--N 1.341 0.222 0 CA-C-N 119.097 0.862 . . . . 0.0 111.524 -172.593 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 115.18 17.91 6.52 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.975 1.274 . . . . 0.0 113.293 -179.33 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' HIS . . . . . 0.597 ' CD2' HD13 ' A' ' 112' ' ' LEU . 4.8 m-70 -72.01 159.95 33.33 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-N 118.404 1.102 . . . . 0.0 111.556 -173.898 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 28.4 p -77.02 -177.15 4.3 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.628 1.971 . . . . 0.0 111.426 175.492 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 3.0 p -160.43 100.81 1.35 Allowed 'General case' 0 C--O 1.235 0.31 0 C-N-CA 123.533 0.733 . . . . 0.0 112.624 166.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 1.3 p -145.49 168.77 19.77 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.724 0.809 . . . . 0.0 109.643 -168.416 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 75.18 108.03 0.07 Allowed 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 126.253 1.821 . . . . 0.0 109.898 175.508 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.488 ' HE3' ' CD2' ' A' ' 100' ' ' HIS . 30.8 ttpt 44.36 58.7 3.64 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.183 1.393 . . . . 0.0 111.828 176.751 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 3.8 tpt 47.03 63.33 1.99 Allowed 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.14 1.376 . . . . 0.0 111.249 -171.702 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 8.6 t-160 70.98 -65.26 0.35 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.423 1.889 . . . . 0.0 113.569 176.039 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 18.4 mt -141.97 118.63 11.03 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 -161.064 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' HIS . . . . . 0.488 ' CD2' ' HE3' ' A' ' 96' ' ' LYS . 13.0 t-160 -69.76 -43.08 72.97 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 118.323 0.51 . . . . 0.0 110.941 172.797 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 67.5 m -145.23 166.89 24.17 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 124.337 1.055 . . . . 0.0 110.199 -164.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 70.4 t -55.35 -35.7 37.86 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 169.42 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 2.8 tpt -52.76 -47.48 67.43 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 125.151 1.38 . . . . 0.0 112.024 175.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -59.06 -50.86 72.48 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.86 -48.83 78.76 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 125.112 1.365 . . . . 0.0 112.83 -172.445 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 19.9 mm -58.72 -45.1 91.2 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 -176.534 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -67.58 -43.0 81.63 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 122.725 0.41 . . . . 0.0 111.135 -178.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 44.6 t80 -50.18 -60.1 3.29 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.429 1.091 . . . . 0.0 110.246 176.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.486 HD11 HD12 ' A' ' 82' ' ' ILE . 9.0 mp -54.77 -45.79 74.31 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 125.04 1.336 . . . . 0.0 111.933 175.026 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -61.16 -31.57 71.3 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 119.606 -0.235 . . . . 0.0 111.515 -179.042 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -78.16 -18.58 55.38 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.923 0.889 . . . . 0.0 112.4 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.597 HD13 ' CD2' ' A' ' 91' ' ' HIS . 47.0 mt -87.16 -43.62 12.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 124.955 1.302 . . . . 0.0 111.104 -177.613 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -68.53 173.02 5.38 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.303 1.041 . . . . 0.0 112.226 -178.59 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.211 0 N-CA-C 107.512 -2.235 . . . . 0.0 107.512 178.991 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 83.8 mmm . . . . . 0 N--CA 1.47 0.574 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 72.8 28.12 67.69 Favored Glycine 0 CA--C 1.526 0.744 0 CA-C-O 119.483 -0.621 . . . . 0.0 111.84 -179.009 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -94.41 -40.73 9.76 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 118.223 1.012 . . . . 0.0 113.002 -175.736 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 146.48 -161.69 28.39 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 107.759 -2.136 . . . . 0.0 107.759 -162.216 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -135.61 93.58 2.97 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 118.317 1.058 . . . . 0.0 109.48 175.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -127.07 164.41 35.57 Favored Pre-proline 0 N--CA 1.474 0.747 0 C-N-CA 124.989 1.316 . . . . 0.0 111.462 -178.856 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.45 -47.43 0.18 Allowed 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.558 2.172 . . . . 0.0 111.595 177.349 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 16.4 t-80 -147.62 148.14 29.91 Favored Pre-proline 0 C--O 1.235 0.311 0 C-N-CA 126.882 2.073 . . . . 0.0 106.738 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -75.91 -32.95 4.05 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 121.318 1.345 . . . . 0.0 112.843 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -84.61 -4.43 58.99 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 117.872 -1.061 . . . . 0.0 112.713 179.369 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 tt -66.97 127.68 33.47 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 119.786 1.176 . . . . 0.0 108.09 165.03 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 24.1 mm -115.26 119.56 62.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 -177.156 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 75.7 m95 -63.66 152.91 85.12 Favored Pre-proline 0 CA--C 1.538 0.491 0 C-N-CA 123.441 0.696 . . . . 0.0 111.749 -177.021 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -74.36 168.89 75.57 Favored 'Cis proline' 0 CA--C 1.532 0.422 0 N-CA-C 113.376 0.491 . . . . 0.0 113.376 -0.155 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -126.97 166.88 16.7 Favored 'General case' 0 CA--C 1.521 -0.151 0 C-N-CA 124.024 0.929 . . . . 0.0 111.258 178.697 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 12.9 mt -143.26 102.37 3.96 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 126.186 1.795 . . . . 0.0 107.051 -178.473 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.9 tp -78.51 138.08 38.24 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 170.618 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.55 91.63 2.81 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 106.608 -1.626 . . . . 0.0 106.608 170.868 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -55.93 147.79 18.7 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 124.005 0.816 . . . . 0.0 111.974 -174.717 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -73.5 97.12 2.51 Favored 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 124.731 1.212 . . . . 0.0 110.345 -178.366 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 133.76 -49.43 0.91 Allowed Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 126.282 1.896 . . . . 0.0 108.978 -177.452 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 35.8 m -65.41 172.96 2.87 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 124.827 1.251 . . . . 0.0 111.076 -178.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 18.0 m-80 -129.29 -31.2 2.09 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 124.736 1.215 . . . . 0.0 109.302 175.376 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -67.27 95.71 0.44 Allowed 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 128.19 2.596 . . . . 0.0 108.963 -175.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.428 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 3.1 mm? -53.36 143.61 18.5 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.734 0.813 . . . . 0.0 109.819 178.537 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.402 ' HA ' ' HD2' ' A' ' 27' ' ' PRO . 1.4 tm? -111.97 87.42 8.65 Favored Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 125.705 1.602 . . . . 0.0 108.603 173.235 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.402 ' HD2' ' HA ' ' A' ' 26' ' ' LEU . 57.6 Cg_endo -62.55 136.81 60.78 Favored 'Trans proline' 0 CA--C 1.535 0.546 1 C-N-CA 125.712 4.275 . . . . 0.0 111.75 174.164 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -124.14 114.79 20.14 Favored 'General case' 0 N--CA 1.462 0.134 0 C-N-CA 125.961 1.704 . . . . 0.0 108.244 170.567 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.6 mmm180 -62.35 -56.21 20.61 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 126.057 1.743 . . . . 0.0 109.995 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 61.6 p -139.05 -178.21 5.24 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 124.353 1.061 . . . . 0.0 108.621 178.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -59.67 -29.54 68.14 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.505 -0.747 . . . . 0.0 111.885 167.099 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -61.67 -23.44 66.09 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.68 0.792 . . . . 0.0 111.168 175.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -84.45 -46.79 11.3 Favored 'General case' 0 C--O 1.223 -0.293 0 C-N-CA 126.335 1.854 . . . . 0.0 109.754 177.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 39.0 t-105 -55.48 -38.5 69.21 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 120.776 -1.203 . . . . 0.0 110.982 175.636 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 4.4 mm100 -61.34 -43.07 99.49 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.599 1.16 . . . . 0.0 111.85 172.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 69.5 mtt85 -65.67 -43.67 88.61 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 118.572 -0.727 . . . . 0.0 110.988 176.514 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -56.09 -51.97 65.97 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.117 0.967 . . . . 0.0 110.934 -178.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 1.9 t -65.21 -32.31 73.92 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 119.937 -0.705 . . . . 0.0 110.898 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -77.11 -16.5 59.16 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 -179.333 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -130.71 21.82 5.04 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 120.147 1.34 . . . . 0.0 111.529 -168.188 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 4.2 m -164.59 -45.85 0.03 OUTLIER 'General case' 0 C--O 1.234 0.255 0 C-N-CA 126.083 1.753 . . . . 0.0 111.05 175.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 6.6 tmtm? 49.16 40.53 17.91 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.633 1.173 . . . . 0.0 112.673 179.206 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.26 170.28 2.38 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.37 -0.831 . . . . 0.0 111.563 176.566 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.598 HD13 ' H ' ' A' ' 44' ' ' LEU 0.301 0.0 OUTLIER -66.14 153.42 42.42 Favored 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 124.953 1.301 . . . . 0.0 112.478 169.376 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.8 mt -137.58 130.18 29.82 Favored 'General case' 0 C--O 1.24 0.563 0 N-CA-C 105.988 -1.856 . . . . 0.0 105.988 172.1 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -136.07 163.99 29.05 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 124.039 0.936 . . . . 0.0 111.591 -168.525 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.401 ' CZ ' ' HA ' ' A' ' 63' ' ' GLU . 3.0 m-85 -69.0 109.86 4.17 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 106.722 -1.584 . . . . 0.0 106.722 -172.051 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.526 ' HA2' HG13 ' A' ' 60' ' ' VAL . . . 116.18 -4.71 20.12 Favored Glycine 0 CA--C 1.528 0.879 0 CA-C-O 117.62 -1.655 . . . . 0.0 114.805 -178.177 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -68.99 -2.64 10.39 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-N 120.703 2.251 . . . . 0.0 116.164 -169.829 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 9.6 ttmt 51.45 119.0 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 131.56 3.944 . . . . 0.0 116.473 167.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 10.3 mt -106.78 149.27 27.51 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 107.81 -1.182 . . . . 0.0 107.81 165.337 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 55.4 t -131.31 148.08 32.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 104.556 -2.386 . . . . 0.0 104.556 167.58 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -127.79 175.3 8.43 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 131.471 3.908 . . . . 0.0 110.36 -169.492 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.0 p -58.71 -35.19 72.26 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.803 0.841 . . . . 0.0 112.896 -179.12 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 40.6 m-20 -83.02 -0.43 48.85 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.657 1.583 . . . . 0.0 113.49 -176.26 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 62.64 22.06 13.09 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 120.028 1.286 . . . . 0.0 111.38 -177.603 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 34.7 m170 -71.02 103.85 2.82 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 119.85 -1.781 . . . . 0.0 110.086 160.497 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.07 146.44 54.18 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 120.108 1.322 . . . . 0.0 107.682 171.113 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -134.3 149.25 50.88 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 124.629 1.172 . . . . 0.0 108.091 174.39 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.526 HG13 ' HA2' ' A' ' 48' ' ' GLY . 37.1 t -137.01 140.11 43.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 C-N-CA 126.798 2.039 . . . . 0.0 106.915 175.587 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 27.9 tp -72.0 138.95 48.33 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 125.738 1.615 . . . . 0.0 107.995 173.641 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -109.86 168.94 9.05 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 124.32 1.048 . . . . 0.0 110.292 178.601 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.401 ' HA ' ' CZ ' ' A' ' 47' ' ' TYR . 16.4 mp0 -60.27 -37.65 81.12 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.866 0.867 . . . . 0.0 110.571 178.357 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -73.48 10.66 0.97 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.95 1.3 . . . . 0.0 113.264 176.611 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 74.14 7.58 4.72 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 127.803 2.441 . . . . 0.0 114.532 164.624 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 2.3 p80 -92.17 168.3 11.45 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.55 1.14 . . . . 0.0 110.296 170.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 58.5 m95 -105.13 96.84 6.8 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 108.177 -1.045 . . . . 0.0 108.177 175.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 53.4 t-80 -69.88 144.39 93.2 Favored Pre-proline 0 CA--C 1.543 0.708 0 CA-C-N 118.013 0.369 . . . . 0.0 110.006 179.451 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -69.4 103.03 1.04 Allowed 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 124.49 3.46 . . . . 0.0 111.262 171.536 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -83.45 37.01 0.55 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.293 1.837 . . . . 0.0 112.395 -178.293 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 67.59 165.28 0.12 Allowed Pre-proline 0 CA--C 1.546 0.809 0 C-N-CA 128.002 2.521 . . . . 0.0 112.716 178.636 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -72.71 174.65 11.42 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 121.526 1.484 . . . . 0.0 113.176 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.6 tt -131.49 143.73 50.42 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 127.157 2.183 . . . . 0.0 108.406 -168.553 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -89.43 166.47 5.29 Favored 'Trans proline' 0 CA--C 1.538 0.725 0 C-N-CA 124.065 3.177 . . . . 0.0 112.396 -178.586 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -58.19 -19.58 42.59 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.898 2.399 . . . . 0.0 113.93 178.607 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -101.56 -17.41 16.4 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 124.127 0.971 . . . . 0.0 111.086 -177.025 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.53 -40.37 98.67 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.135 -1.186 . . . . 0.0 110.135 174.878 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 54.6 tp -60.83 -50.21 74.35 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 179.018 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -63.61 -19.64 65.02 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.638 1.175 . . . . 0.0 111.793 -177.391 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -77.43 -47.13 20.54 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 119.696 1.135 . . . . 0.0 110.793 170.741 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 29.4 mt -57.63 -54.46 46.58 Favored 'General case' 0 N--CA 1.466 0.367 0 O-C-N 121.807 -0.558 . . . . 0.0 110.305 174.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 20.2 mm -58.11 -33.1 45.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 C-N-CA 125.084 1.354 . . . . 0.0 110.443 -178.249 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.86 -33.73 37.63 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 119.081 0.855 . . . . 0.0 111.729 174.369 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.4 -54.43 40.43 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 119.159 0.89 . . . . 0.0 110.472 -177.291 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.442 ' HE2' HD12 ' A' ' 112' ' ' LEU . 8.6 t60 -64.15 -39.33 93.8 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.478 0.711 . . . . 0.0 109.941 179.072 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 80.6 m -70.2 -40.82 74.37 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 121.327 -0.858 . . . . 0.0 111.405 -178.015 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -75.92 -31.06 58.96 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 118.925 0.784 . . . . 0.0 111.884 -177.262 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.8 t -66.1 -40.67 90.95 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 176.2 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 98.0 mt -81.16 -70.7 0.51 Allowed 'General case' 0 C--N 1.341 0.238 0 CA-C-O 118.596 -0.716 . . . . 0.0 109.256 -176.294 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 153.2 39.63 0.02 OUTLIER Glycine 0 CA--C 1.53 0.989 0 CA-C-O 118.572 -1.127 . . . . 0.0 113.768 171.788 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -107.14 156.33 18.93 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 118.938 1.369 . . . . 0.0 111.841 -172.035 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 22.5 p -147.03 35.06 0.9 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.288 1.035 . . . . 0.0 113.704 -166.422 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 5.1 p 58.89 174.62 0.07 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 131.472 3.909 . . . . 0.0 111.357 -171.116 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 18.6 p -128.15 -59.23 1.18 Allowed 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.268 -0.895 . . . . 0.0 110.711 -177.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 5.1 t -147.99 15.49 1.06 Allowed 'General case' 0 C--O 1.233 0.188 0 O-C-N 120.996 -1.065 . . . . 0.0 113.207 -173.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.579 ' HE3' ' HB2' ' A' ' 100' ' ' HIS . 0.7 OUTLIER -141.94 178.33 7.59 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.155 0.982 . . . . 0.0 109.611 177.888 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.417 ' H ' ' CE ' ' A' ' 97' ' ' MET . 0.0 OUTLIER -74.98 76.84 2.19 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 126.137 1.775 . . . . 0.0 106.83 176.484 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 58.72 -67.44 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.588 1.155 . . . . 0.0 110.133 -155.648 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.638 HD13 ' HB2' ' A' ' 105' ' ' ALA . 81.3 mt -144.47 171.24 14.63 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 128.385 2.674 . . . . 0.0 110.126 -157.063 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' HIS . . . . . 0.579 ' HB2' ' HE3' ' A' ' 96' ' ' LYS . 29.7 t-80 -106.48 -27.16 11.08 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 126.217 1.807 . . . . 0.0 112.156 176.158 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 3.0 m -172.86 172.79 3.96 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.139 1.376 . . . . 0.0 111.392 -172.804 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 34.7 t -66.56 -44.66 89.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 175.415 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 51.2 tpp -56.99 -40.11 75.95 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.398 -0.814 . . . . 0.0 111.506 178.886 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -69.11 -31.33 69.95 Favored 'General case' 0 C--O 1.233 0.195 0 O-C-N 122.17 -0.331 . . . . 0.0 110.85 179.318 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.638 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -64.24 -46.87 81.88 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.656 1.182 . . . . 0.0 110.043 173.042 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 42.4 mm -56.68 -37.45 52.9 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.215 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 176.103 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.46 -47.35 61.03 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 119.331 0.968 . . . . 0.0 111.399 177.176 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -54.41 -55.2 31.14 Favored 'General case' 0 N--CA 1.461 0.083 0 C-N-CA 125.563 1.545 . . . . 0.0 111.57 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 63.7 mt -62.72 -34.86 78.04 Favored 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 124.527 1.131 . . . . 0.0 110.721 -173.218 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -74.18 -44.22 54.28 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 124.293 1.037 . . . . 0.0 110.251 -176.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -64.88 2.5 0.7 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.608 1.563 . . . . 0.0 114.2 178.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.442 HD12 ' HE2' ' A' ' 85' ' ' HIS . 69.7 mt -79.93 -22.02 43.2 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 124.216 1.006 . . . . 0.0 112.1 169.179 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -86.06 95.95 9.7 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 121.715 0.769 . . . . 0.0 109.799 -174.058 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.399 0 N-CA-C 108.787 -1.725 . . . . 0.0 108.787 158.262 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.474 0.738 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -157.38 -86.96 0.06 OUTLIER Glycine 0 C--N 1.337 0.622 0 CA-C-N 119.405 1.002 . . . . 0.0 111.617 -170.088 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 58.69 178.32 0.07 Allowed 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 127.205 2.202 . . . . 0.0 114.214 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 86.02 -83.27 1.62 Allowed Glycine 0 CA--C 1.524 0.617 0 O-C-N 121.381 -0.825 . . . . 0.0 112.859 167.162 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -149.98 4.4 0.55 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 115.774 1.768 . . . . 0.0 115.774 -165.26 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -143.84 160.59 49.59 Favored Pre-proline 0 C--N 1.308 -1.234 0 C-N-CA 126.765 2.026 . . . . 0.0 109.561 168.046 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -67.72 -49.27 1.18 Allowed 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.685 2.257 . . . . 0.0 112.002 175.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' HIS . . . . . 0.409 ' HD1' ' HB2' ' A' ' 10' ' ' GLN . 4.5 t-80 -158.77 144.88 12.41 Favored Pre-proline 0 CA--C 1.534 0.332 0 CA-C-O 117.645 -1.169 . . . . 0.0 110.81 -175.195 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -72.24 -20.58 24.43 Favored 'Trans proline' 0 CA--C 1.534 0.486 0 C-N-CA 123.157 2.571 . . . . 0.0 112.96 175.001 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.409 ' HB2' ' HD1' ' A' ' 8' ' ' HIS . 25.9 mt-30 -85.03 -9.4 58.05 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.282 -0.886 . . . . 0.0 111.9 176.931 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.3 tt -78.67 132.21 36.95 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 123.957 0.903 . . . . 0.0 109.713 170.658 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 24.1 mm -120.53 114.11 42.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 176.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -56.5 153.8 19.28 Favored Pre-proline 0 C--O 1.238 0.456 0 CA-C-O 118.874 -0.584 . . . . 0.0 111.642 178.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -68.56 172.16 45.33 Favored 'Cis proline' 0 CA--C 1.535 0.563 0 N-CA-C 114.195 0.806 . . . . 0.0 114.195 -1.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -136.2 171.63 14.19 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.521 0.728 . . . . 0.0 112.132 176.105 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 14.5 mt -143.38 108.32 4.93 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 127.555 2.342 . . . . 0.0 106.901 -177.634 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.6 tp -83.3 148.38 27.4 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 170.369 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.66 90.26 1.91 Allowed 'General case' 0 C--O 1.238 0.499 0 CA-C-N 119.739 1.154 . . . . 0.0 109.759 171.07 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -48.98 152.48 1.05 Allowed 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 125.687 1.595 . . . . 0.0 111.932 -172.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -70.16 -11.18 60.71 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.835 0.68 . . . . 0.0 112.835 173.686 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -95.79 -17.66 34.86 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 124.995 1.283 . . . . 0.0 113.57 -178.675 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 1.3 m -129.81 -176.48 3.93 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 119.254 1.527 . . . . 0.0 110.583 -171.81 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -132.21 -19.47 2.5 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 126.352 1.861 . . . . 0.0 110.612 -176.004 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -67.68 155.36 39.39 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 167.727 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.3 mt -102.0 165.11 11.35 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 125.079 1.352 . . . . 0.0 108.937 172.456 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -118.19 88.33 32.11 Favored Pre-proline 0 C--N 1.328 -0.346 0 C-N-CA 125.774 1.63 . . . . 0.0 108.468 171.413 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -62.2 128.59 24.37 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 122.682 2.255 . . . . 0.0 110.225 173.039 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -120.56 109.07 14.82 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.15 1.38 . . . . 0.0 108.056 172.62 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 79.0 mtm180 -66.14 -47.79 72.91 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 125.344 1.458 . . . . 0.0 113.048 -173.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.14 168.11 22.44 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 126.351 1.86 . . . . 0.0 106.508 -177.468 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 -53.56 -33.28 54.15 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 126.24 1.816 . . . . 0.0 113.628 -176.125 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -56.53 -35.29 67.92 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.49 1.516 . . . . 0.0 111.575 175.298 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -66.67 -47.27 73.01 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.264 1.826 . . . . 0.0 109.891 -177.273 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 36.1 t-105 -61.88 -41.27 97.68 Favored 'General case' 0 C--N 1.345 0.38 0 O-C-N 120.771 -1.206 . . . . 0.0 110.719 176.264 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -59.56 -54.79 42.51 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 175.147 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 61.7 mtp180 -56.71 -34.39 67.42 Favored 'General case' 0 C--O 1.226 -0.147 0 CA-C-O 117.656 -1.164 . . . . 0.0 112.408 179.557 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -54.15 -68.61 0.17 Allowed 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 119.854 1.206 . . . . 0.0 110.75 177.228 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -73.31 -10.24 59.54 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 120.049 1.295 . . . . 0.0 111.317 -178.478 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -68.36 -45.75 71.95 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.887 1.222 . . . . 0.0 109.918 167.016 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -105.28 -16.07 14.87 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 -169.239 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.2 t -151.94 80.81 1.27 Allowed 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 127.928 2.491 . . . . 0.0 107.092 -168.241 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -75.76 59.68 1.22 Allowed 'General case' 0 N--CA 1.465 0.282 0 O-C-N 121.168 -0.957 . . . . 0.0 109.907 173.038 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -56.11 150.5 13.84 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 125.736 1.614 . . . . 0.0 108.807 173.598 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -56.28 129.78 41.77 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.778 1.631 . . . . 0.0 109.302 174.541 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 36.1 mt -118.58 139.48 51.41 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 125.241 1.416 . . . . 0.0 108.239 176.574 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -144.83 150.38 37.03 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 121.85 0.833 . . . . 0.0 110.647 -166.787 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.423 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 3.4 m-85 -62.13 130.1 43.88 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 173.508 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 100.55 5.87 53.54 Favored Glycine 0 CA--C 1.527 0.833 0 CA-C-O 118.441 -1.199 . . . . 0.0 114.301 -176.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -75.71 -6.76 52.07 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 115.905 1.817 . . . . 0.0 115.905 -166.775 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 16.2 ttmt 53.07 130.71 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 130.238 3.415 . . . . 0.0 116.692 173.486 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 5.9 tp -122.02 154.76 36.83 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 175.402 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 41.0 t -138.04 131.6 41.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 C-N-CA 126.587 1.955 . . . . 0.0 107.0 175.082 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -107.14 -178.75 3.73 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.446 1.498 . . . . 0.0 113.41 178.689 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.436 ' HA ' HG21 ' A' ' 102' ' ' VAL . 8.6 t -56.72 -13.94 2.91 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 128.385 2.674 . . . . 0.0 115.103 177.596 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -122.69 11.87 9.84 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 126.823 2.049 . . . . 0.0 109.733 -173.64 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 66.96 16.43 10.36 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.895 1.678 . . . . 0.0 110.589 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 25.0 m170 -61.45 108.53 0.96 Allowed 'General case' 0 C--O 1.24 0.565 0 CA-C-N 120.363 1.438 . . . . 0.0 107.995 168.506 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -82.29 149.42 27.8 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 173.556 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -138.55 164.49 29.3 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 171.087 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 25.6 t -133.27 138.78 50.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 C-N-CA 128.087 2.555 . . . . 0.0 106.425 172.188 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 16.0 tp -80.16 137.32 36.68 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 171.155 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -121.84 170.91 9.31 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.38 1.072 . . . . 0.0 110.371 174.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.625 ' H ' ' CD ' ' A' ' 63' ' ' GLU . 0.7 OUTLIER -66.99 -18.57 65.45 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.584 1.553 . . . . 0.0 111.433 -171.086 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -78.16 16.45 0.76 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.903 1.281 . . . . 0.0 110.958 172.229 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 61.45 0.97 0.5 Allowed 'General case' 0 C--O 1.239 0.549 0 C-N-CA 129.746 3.219 . . . . 0.0 114.979 176.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 2.2 p-80 -85.12 156.49 21.03 Favored 'General case' 0 N--CA 1.437 -1.105 0 CA-C-O 121.781 0.801 . . . . 0.0 109.269 175.738 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 81.4 m95 -83.93 142.52 30.48 Favored 'General case' 0 N--CA 1.437 -1.077 0 N-CA-C 104.801 -2.296 . . . . 0.0 104.801 153.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 65.8 t60 -114.1 143.99 30.76 Favored Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 171.663 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.78 103.3 0.98 Allowed 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 124.574 3.516 . . . . 0.0 111.058 176.87 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -79.6 29.91 0.24 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.705 1.602 . . . . 0.0 111.857 177.516 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 66.5 165.47 0.12 Allowed Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 128.156 2.583 . . . . 0.0 111.705 -173.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -63.36 170.23 8.34 Favored 'Trans proline' 0 N--CA 1.45 -1.034 0 C-N-CA 121.179 1.253 . . . . 0.0 110.864 167.574 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 13.4 tp -123.82 145.83 48.82 Favored Pre-proline 0 C--O 1.237 0.421 0 C-N-CA 124.519 1.127 . . . . 0.0 109.211 -174.346 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -61.46 158.78 34.6 Favored 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 123.33 2.686 . . . . 0.0 111.484 174.767 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -59.2 -27.23 84.45 Favored 'Trans proline' 0 N--CA 1.457 -0.674 0 C-N-CA 122.634 2.223 . . . . 0.0 112.398 179.159 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -96.11 -12.37 24.88 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.599 0.76 . . . . 0.0 111.102 -173.694 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.43 -28.12 68.37 Favored Glycine 0 CA--C 1.527 0.833 0 C-N-CA 123.807 0.718 . . . . 0.0 111.753 175.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 36.4 tp -52.95 -59.23 4.78 Favored 'General case' 0 C--N 1.34 0.158 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 165.43 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -62.59 -20.13 64.42 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.898 1.279 . . . . 0.0 112.13 -169.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -75.48 -44.94 41.35 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.577 1.151 . . . . 0.0 111.141 172.386 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 41.4 mt -61.65 -44.09 97.63 Favored 'General case' 0 C--O 1.234 0.257 0 O-C-N 121.009 -1.057 . . . . 0.0 110.08 173.664 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 37.0 mm -56.95 -41.52 77.02 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 123.25 0.62 . . . . 0.0 109.514 173.154 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -50.38 -42.83 54.0 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 124.413 1.085 . . . . 0.0 112.309 -179.18 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -67.44 -43.63 80.66 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 119.1 0.864 . . . . 0.0 110.952 -179.109 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 -58.68 -46.38 87.36 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 177.356 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 30.5 m -60.41 -44.31 95.84 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-O 118.361 -0.828 . . . . 0.0 111.244 175.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -71.48 -27.78 63.47 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 117.623 -1.179 . . . . 0.0 112.094 -172.072 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 8.4 t -70.86 -40.77 72.11 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 119.984 1.266 . . . . 0.0 108.872 177.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 58.8 mt -89.47 -63.5 1.28 Allowed 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 -174.476 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 157.7 9.57 0.05 OUTLIER Glycine 0 CA--C 1.536 1.351 0 C-N-CA 125.412 1.482 . . . . 0.0 114.428 174.755 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 21.6 p80 -109.31 48.58 0.87 Allowed 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 120.354 2.077 . . . . 0.0 114.237 -150.771 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 69.3 m -60.39 170.48 1.33 Allowed 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.062 -1.649 . . . . 0.0 111.658 179.338 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -49.4 150.97 1.65 Allowed 'General case' 0 C--O 1.234 0.258 0 C-N-CA 125.594 1.558 . . . . 0.0 112.463 -167.433 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 82.7 p -129.03 -38.1 1.65 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.189 -179.493 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -141.25 156.27 45.91 Favored 'General case' 0 N--CA 1.438 -1.059 0 C-N-CA 125.512 1.525 . . . . 0.0 109.455 -170.166 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . 0.316 0.0 OUTLIER 44.61 -162.98 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 127.116 2.166 . . . . 0.0 113.262 178.835 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 11.3 ptm -71.84 59.37 0.35 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.218 1.007 . . . . 0.0 110.292 167.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 67.39 -69.92 0.13 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.849 1.659 . . . . 0.0 109.658 -173.753 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.416 HD13 ' CB ' ' A' ' 105' ' ' ALA . 75.2 mt -142.67 141.3 31.84 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 126.643 1.977 . . . . 0.0 109.37 -169.246 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 9.8 t-160 -75.75 -27.22 58.01 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.063 0.545 . . . . 0.0 112.082 -174.5 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 11.2 p 179.69 179.56 0.49 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.191 1.396 . . . . 0.0 109.692 -174.476 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.436 HG21 ' HA ' ' A' ' 54' ' ' SER . 6.5 t -64.65 -45.53 95.09 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.21 0 C-N-CA 123.58 0.752 . . . . 0.0 109.054 -178.849 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 6.7 tpt -62.98 -32.82 74.25 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 121.727 -0.608 . . . . 0.0 110.682 -177.296 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.76 -37.84 70.46 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.186 0.994 . . . . 0.0 109.491 177.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.416 ' CB ' HD13 ' A' ' 99' ' ' LEU . . . -63.74 -43.15 97.35 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 125.635 1.574 . . . . 0.0 112.455 176.159 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 33.9 mm -61.26 -50.63 79.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -179.503 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -66.34 -39.16 89.02 Favored 'General case' 0 C--O 1.226 -0.177 0 O-C-N 123.369 0.418 . . . . 0.0 110.326 -176.798 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -53.91 -56.37 18.36 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 124.548 1.139 . . . . 0.0 111.117 172.715 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 31.7 mt -62.43 -38.78 91.04 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 111.761 0.282 . . . . 0.0 111.761 -177.565 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -64.87 -41.41 95.69 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 177.244 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -70.33 -13.35 62.11 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 118.111 -0.947 . . . . 0.0 113.161 -178.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 94.9 mt -60.9 -34.12 74.17 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 120.082 1.31 . . . . 0.0 110.934 172.456 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.23 158.87 28.81 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 125.618 1.567 . . . . 0.0 112.496 -167.207 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.018 0 C-N-CA 127.333 2.397 . . . . 0.0 107.676 167.38 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.0 mmm . . . . . 0 N--CA 1.474 0.752 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -64.16 153.43 48.25 Favored Glycine 0 CA--C 1.524 0.635 0 CA-C-O 121.328 0.405 . . . . 0.0 112.922 -175.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -151.83 163.56 38.93 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 126.059 1.744 . . . . 0.0 108.221 174.259 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.408 ' C ' ' H ' ' A' ' 6' ' ' THR . . . -155.45 165.52 32.44 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 107.505 -2.238 . . . . 0.0 107.505 163.6 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 43.95 3.74 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 131.065 3.746 . . . . 0.0 118.751 -170.523 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.408 ' H ' ' C ' ' A' ' 4' ' ' GLY . 0.1 OUTLIER -155.67 164.93 19.59 Favored Pre-proline 0 C--N 1.316 -0.87 1 C-N-CA 131.739 4.016 . . . . 0.0 109.188 -178.618 . . . . . . . . 4 4 . 1 . 017 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -77.92 -165.08 0.31 Allowed 'Trans proline' 0 CA--C 1.548 1.185 0 C-N-CA 124.418 3.412 . . . . 0.0 111.96 179.398 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 26.8 t-80 -53.6 143.73 36.71 Favored Pre-proline 0 CA--C 1.539 0.541 0 C-N-CA 124.496 1.118 . . . . 0.0 110.759 -173.214 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -71.51 6.12 2.07 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 C-N-CA 123.907 3.071 . . . . 0.0 114.879 -177.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -125.23 -5.86 7.2 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.143 1.377 . . . . 0.0 112.317 177.32 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.7 tt -54.98 151.55 8.69 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 119.578 1.081 . . . . 0.0 109.931 166.159 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 12.6 mm -127.04 140.61 48.6 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.115 0 N-CA-C 105.928 -1.879 . . . . 0.0 105.928 174.331 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 78.9 m95 -81.04 159.96 67.04 Favored Pre-proline 0 CA--C 1.537 0.459 0 O-C-N 121.938 -0.476 . . . . 0.0 110.889 177.5 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.77 170.68 52.84 Favored 'Cis proline' 0 N--CA 1.455 -0.751 0 C-N-CA 124.866 -0.889 . . . . 0.0 112.621 -11.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -136.61 170.91 15.29 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.073 0.949 . . . . 0.0 111.544 -179.175 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 15.7 mt -142.68 103.38 4.21 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 127.611 2.364 . . . . 0.0 108.103 -171.66 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.0 tp -81.1 156.1 25.95 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 118.385 -0.817 . . . . 0.0 108.82 172.368 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -136.87 78.05 1.68 Allowed 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 120.321 1.419 . . . . 0.0 111.425 172.63 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -45.81 119.79 2.37 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 126.236 1.814 . . . . 0.0 110.972 -169.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.68 99.37 1.67 Allowed 'General case' 0 N--CA 1.44 -0.959 0 C-N-CA 122.958 0.503 . . . . 0.0 110.382 -164.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 132.79 -46.9 1.03 Allowed Glycine 0 CA--C 1.532 1.106 0 C-N-CA 127.743 2.592 . . . . 0.0 109.625 -173.17 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 74.9 m -68.33 -33.57 74.54 Favored 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 126.646 1.978 . . . . 0.0 114.319 -169.638 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.708 ' HB3' ' HB1' ' A' ' 84' ' ' ALA . 4.2 m-80 68.85 -27.04 0.15 Allowed 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 127.271 2.228 . . . . 0.0 114.422 -176.421 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -52.7 116.58 2.38 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 127.627 2.371 . . . . 0.0 109.569 169.838 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.669 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 4.4 mm? -73.32 136.93 44.53 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 106.908 -1.516 . . . . 0.0 106.908 168.107 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -106.73 87.07 2.58 Favored Pre-proline 0 C--O 1.239 0.529 0 C-N-CA 127.319 2.247 . . . . 0.0 108.652 -176.782 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -61.82 147.37 95.39 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 122.21 1.94 . . . . 0.0 109.74 176.063 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.2 mt -138.59 116.71 11.77 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 105.542 -2.021 . . . . 0.0 105.542 178.305 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 25.4 mtt-85 -82.16 -39.55 23.07 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 120.615 1.552 . . . . 0.0 114.305 -175.143 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.7 t -145.91 -177.04 5.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 120.367 1.439 . . . . 0.0 108.802 167.2 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.96 -25.77 58.49 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.39 1.876 . . . . 0.0 112.576 -178.879 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -68.24 -29.62 68.48 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.08 0.952 . . . . 0.0 111.212 173.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -70.28 -33.39 71.52 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 121.252 -0.905 . . . . 0.0 110.407 -176.832 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 46.1 t-105 -60.86 -32.97 72.38 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.754 -0.592 . . . . 0.0 111.35 170.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 -66.75 -42.77 85.63 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 118.474 0.579 . . . . 0.0 111.162 173.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? -54.22 -44.13 71.41 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 119.047 0.84 . . . . 0.0 110.243 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -58.2 -50.46 73.46 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-O 119.565 -0.255 . . . . 0.0 110.828 178.624 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 15.1 p -73.66 -14.07 61.1 Favored 'General case' 0 N--CA 1.464 0.246 0 O-C-N 119.982 -1.699 . . . . 0.0 113.32 -176.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.06 -34.62 71.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 117.614 -1.184 . . . . 0.0 111.122 166.357 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -120.68 -15.64 8.39 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 116.407 2.002 . . . . 0.0 116.407 -167.213 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 49.8 m -138.79 11.58 2.68 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 129.979 3.312 . . . . 0.0 109.994 -175.826 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 45.3 37.94 3.17 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 127.46 2.304 . . . . 0.0 113.458 161.057 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . 0.271 0.1 OUTLIER 48.67 30.09 2.42 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 125.002 1.321 . . . . 0.0 113.547 178.962 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.408 HD23 ' HA ' ' A' ' 44' ' ' LEU . 2.8 mt -54.37 116.15 2.48 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 106.073 -1.825 . . . . 0.0 106.073 164.858 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 90.3 mt -143.2 118.17 10.01 Favored 'General case' 0 C--O 1.24 0.575 0 N-CA-C 102.117 -3.29 . . . . 0.0 102.117 -176.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -118.24 160.85 20.89 Favored 'General case' 0 C--O 1.234 0.284 0 O-C-N 123.858 0.724 . . . . 0.0 110.038 -170.633 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -66.04 124.01 21.42 Favored 'General case' 0 CA--C 1.514 -0.429 0 C-N-CA 120.161 -0.616 . . . . 0.0 109.362 -164.689 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 103.6 0.82 46.5 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-O 117.747 -1.585 . . . . 0.0 113.821 -176.877 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -55.8 -29.37 59.61 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.808 1.643 . . . . 0.0 113.797 -167.652 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.419 ' HA ' ' O ' ' A' ' 59' ' ' PHE . 17.5 ttmt 54.97 155.08 0.01 OUTLIER 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 128.672 2.789 . . . . 0.0 114.889 -179.803 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.1 mt -141.87 140.82 32.99 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.089 174.722 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 99.0 t -134.05 120.87 36.74 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 125.322 1.449 . . . . 0.0 108.479 177.367 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 26.5 p30 -99.78 173.41 6.71 Favored 'General case' 0 C--N 1.329 -0.296 1 C-N-CA 132.018 4.127 . . . . 0.0 111.181 178.745 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.25 2.69 0.05 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.837 1.655 . . . . 0.0 114.65 174.763 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -123.44 5.14 9.02 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.921 1.688 . . . . 0.0 110.581 -174.342 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.45 ' CE2' ' HA ' ' A' ' 75' ' ' PRO . 11.7 m-85 61.82 14.88 6.59 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.188 1.795 . . . . 0.0 112.877 172.928 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 8.9 m170 -66.01 109.05 2.41 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 124.708 1.203 . . . . 0.0 109.713 163.235 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 97.4 m -72.15 140.15 48.66 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 118.168 -1.413 . . . . 0.0 108.43 166.783 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.419 ' O ' ' HA ' ' A' ' 50' ' ' LYS . 55.1 m-85 -124.94 159.89 30.14 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-O 117.749 -1.12 . . . . 0.0 108.76 165.663 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.449 HG12 ' HB2' ' A' ' 70' ' ' ALA . 1.6 p -150.28 153.29 10.61 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.419 0 CA-C-N 120.522 1.51 . . . . 0.0 112.402 171.674 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 17.5 tp -77.87 131.9 37.72 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 126.071 1.748 . . . . 0.0 108.727 -177.697 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -105.75 174.61 5.81 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 123.74 0.816 . . . . 0.0 110.479 179.092 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -68.89 -2.42 9.62 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.272 -0.893 . . . . 0.0 112.927 172.559 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -85.87 0.78 52.17 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 120.369 -1.457 . . . . 0.0 112.153 165.006 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 51.87 8.94 0.07 Allowed 'General case' 0 C--O 1.237 0.426 0 C-N-CA 128.104 2.562 . . . . 0.0 113.953 -164.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -77.72 174.16 11.27 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 167.55 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 74.7 m95 -114.49 136.94 52.46 Favored 'General case' 0 N--CA 1.44 -0.944 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 -179.596 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -118.31 144.71 35.59 Favored Pre-proline 0 N--CA 1.45 -0.472 0 C-N-CA 126.013 1.725 . . . . 0.0 110.401 -170.305 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -79.28 101.97 1.47 Allowed 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 124.697 3.598 . . . . 0.0 110.073 -178.776 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.449 ' HB2' HG12 ' A' ' 60' ' ' VAL . . . -83.35 24.68 0.8 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.212 1.405 . . . . 0.0 112.625 179.432 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 67.8 165.11 0.13 Allowed Pre-proline 0 CA--C 1.543 0.679 0 C-N-CA 128.836 2.854 . . . . 0.0 111.99 -178.09 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -70.54 175.38 8.82 Favored 'Trans proline' 0 N--CA 1.452 -0.956 0 C-N-CA 121.263 1.309 . . . . 0.0 111.947 175.062 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 13.4 tp -126.6 155.36 74.9 Favored Pre-proline 0 CA--C 1.539 0.549 0 C-N-CA 126.813 2.045 . . . . 0.0 108.772 -172.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -73.14 165.67 32.07 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 121.793 1.662 . . . . 0.0 110.113 164.126 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.45 ' HA ' ' CE2' ' A' ' 56' ' ' PHE . 18.5 Cg_endo -59.32 -36.41 94.63 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.544 2.163 . . . . 0.0 112.459 177.767 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -78.97 -25.29 43.47 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 122.455 0.302 . . . . 0.0 110.245 -174.409 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.13 -24.58 67.28 Favored Glycine 0 CA--C 1.53 1.029 0 CA-C-O 119.137 -0.813 . . . . 0.0 113.189 -174.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 23.4 tp -55.09 -46.16 75.48 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 124.832 1.253 . . . . 0.0 109.962 168.737 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -75.39 -15.26 60.47 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 123.603 0.761 . . . . 0.0 110.632 -168.583 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -68.36 -44.84 74.34 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.063 -1.023 . . . . 0.0 110.981 164.215 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.8 mp -58.15 -56.93 15.75 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 175.506 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 6.0 mm -53.19 -34.19 21.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 C-N-CA 125.059 1.344 . . . . 0.0 110.986 -178.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 12.2 ttt-85 -48.02 -38.89 18.22 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 119.381 0.992 . . . . 0.0 112.559 175.499 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.708 ' HB1' ' HB3' ' A' ' 23' ' ' ASN . . . -71.37 -42.96 67.77 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.373 0.988 . . . . 0.0 111.773 -179.074 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.669 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 13.5 t60 -55.24 -55.05 35.72 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.778 0.799 . . . . 0.0 109.281 170.719 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 95.1 m -68.29 -29.04 67.73 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 121.324 -0.86 . . . . 0.0 111.333 -172.13 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -78.95 -24.26 44.04 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 117.373 -1.299 . . . . 0.0 112.602 178.89 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.4 t -92.6 -17.75 23.97 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.914 0.779 . . . . 0.0 110.821 -177.136 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 70.1 mt -107.28 -22.35 12.63 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.581 0.752 . . . . 0.0 111.877 178.134 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 79.96 53.83 4.09 Favored Glycine 0 C--N 1.337 0.614 0 N-CA-C 110.913 -0.875 . . . . 0.0 110.913 -177.24 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' HIS . . . . . 0.421 ' CD2' HD13 ' A' ' 112' ' ' LEU . 35.3 m-70 -106.61 -36.67 6.67 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 122.969 0.508 . . . . 0.0 110.673 177.052 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 37.3 m 52.64 -164.87 0.07 Allowed 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.241 1.016 . . . . 0.0 112.187 -173.006 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 1.5 p -88.92 179.58 6.15 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 126.462 1.905 . . . . 0.0 111.672 -179.084 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 40.2 p -135.46 -77.77 0.44 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.039 1.336 . . . . 0.0 108.894 -178.171 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 69.1 m -132.9 178.71 6.67 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 126.491 1.916 . . . . 0.0 109.224 174.251 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . 0.394 0.0 OUTLIER 44.57 33.7 0.97 Allowed 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 128.321 2.648 . . . . 0.0 114.948 178.664 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 12.3 ttp 58.81 73.29 0.49 Allowed 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 125.375 1.47 . . . . 0.0 108.567 -178.314 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 7.9 m80 73.31 -75.31 0.08 Allowed 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 127.246 2.218 . . . . 0.0 111.831 -171.001 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.597 HD13 ' HB2' ' A' ' 105' ' ' ALA . 84.5 mt -150.69 154.39 37.32 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 124.519 1.128 . . . . 0.0 109.655 -159.738 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 16.0 t-160 -83.85 -40.01 19.2 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 124.571 1.169 . . . . 0.0 111.397 173.055 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 88.8 p -172.26 -175.36 1.4 Allowed 'General case' 0 C--O 1.236 0.351 0 C-N-CA 124.241 1.017 . . . . 0.0 110.414 -171.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 67.5 t -55.0 -45.27 76.67 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.291 0 C-N-CA 125.106 1.362 . . . . 0.0 110.329 177.641 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 2.8 ttm -62.29 -45.63 92.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 118.527 0.603 . . . . 0.0 110.113 -171.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.55 -39.8 85.18 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 124.559 1.144 . . . . 0.0 110.08 173.167 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.597 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -61.62 -53.82 51.07 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 123.691 0.796 . . . . 0.0 111.566 178.363 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 32.4 mm -53.86 -47.08 64.19 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 -178.391 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -60.12 -51.54 69.16 Favored 'General case' 0 CA--C 1.521 -0.153 0 C-N-CA 123.71 0.804 . . . . 0.0 111.163 -179.813 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.401 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 13.0 t80 -53.27 -65.13 0.62 Allowed 'General case' 0 C--O 1.221 -0.42 0 C-N-CA 126.371 1.868 . . . . 0.0 110.176 178.606 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 9.2 mp -52.29 -45.12 65.36 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 125.784 1.634 . . . . 0.0 112.015 -178.887 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -65.35 -33.98 77.23 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 118.668 0.667 . . . . 0.0 111.548 177.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -80.57 -18.74 47.4 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.741 0.816 . . . . 0.0 112.836 177.631 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.421 HD13 ' CD2' ' A' ' 91' ' ' HIS . 63.6 mt -77.56 -28.53 51.82 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 124.317 1.047 . . . . 0.0 110.98 173.643 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -71.69 162.51 29.33 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-O 121.649 0.738 . . . . 0.0 112.066 174.709 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.358 0 CA-C-O 122.714 1.174 . . . . 0.0 111.267 173.601 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.2 tpp . . . . . 0 N--CA 1.468 0.462 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 172.87 -64.1 0.13 Allowed Glycine 0 N--CA 1.449 -0.438 0 N-CA-C 105.796 -2.922 . . . . 0.0 105.796 -176.557 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -147.97 160.0 43.29 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 124.567 1.147 . . . . 0.0 108.016 160.379 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -96.65 -27.13 9.96 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 110.411 -1.076 . . . . 0.0 110.411 163.167 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 53.41 9.26 0.15 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.984 2.113 . . . . 0.0 114.332 -172.417 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.02 160.1 76.98 Favored Pre-proline 0 C--O 1.238 0.489 0 C-N-CA 128.146 2.578 . . . . 0.0 111.662 -175.391 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -71.91 70.23 2.91 Favored 'Trans proline' 0 N--CA 1.45 -1.062 0 C-N-CA 123.076 2.517 . . . . 0.0 110.089 169.57 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 75.55 148.09 0.12 Allowed Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 129.098 2.959 . . . . 0.0 113.432 -176.812 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -78.1 -28.74 4.61 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 122.688 2.259 . . . . 0.0 113.25 173.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -69.93 -22.34 63.2 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.701 1.137 . . . . 0.0 112.293 176.322 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 tt -63.77 135.56 56.74 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 166.368 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 3.0 tt -107.85 178.92 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.165 0 C-N-CA 124.286 1.035 . . . . 0.0 108.443 176.029 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 58.2 m95 -122.87 149.87 57.49 Favored Pre-proline 0 C--O 1.237 0.4 0 O-C-N 121.586 -0.696 . . . . 0.0 109.568 172.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -68.69 162.59 80.6 Favored 'Cis proline' 0 CA--C 1.542 0.917 0 N-CA-C 114.713 1.005 . . . . 0.0 114.713 -1.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.585 ' HA ' HD22 ' A' ' 16' ' ' LEU . . . -139.8 169.79 17.08 Favored 'General case' 0 CA--C 1.519 -0.219 0 C-N-CA 127.088 2.155 . . . . 0.0 110.967 -177.503 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.683 HD21 HG13 ' A' ' 102' ' ' VAL . 2.8 mm? -138.79 112.93 8.64 Favored 'General case' 0 N--CA 1.436 -1.164 0 C-N-CA 126.895 2.078 . . . . 0.0 108.597 -156.192 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 22.2 tp -99.72 151.51 21.15 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 123.772 0.67 . . . . 0.0 109.469 169.138 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.48 88.54 2.15 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 171.648 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -52.94 138.0 31.17 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 118.195 0.452 . . . . 0.0 110.381 -171.649 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -59.02 109.92 0.93 Allowed 'General case' 0 N--CA 1.433 -1.321 0 C-N-CA 124.69 1.196 . . . . 0.0 108.364 178.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 110.09 -36.17 4.43 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 126.201 1.858 . . . . 0.0 112.825 -179.231 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 1.8 p -69.45 171.27 9.0 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 119.661 1.731 . . . . 0.0 109.151 177.083 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 11.5 m-80 -116.8 -16.49 10.62 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.622 -1.172 . . . . 0.0 108.883 172.584 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -76.83 109.59 10.75 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 124.359 1.064 . . . . 0.0 108.851 -170.286 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.466 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 4.1 mm? -68.74 137.22 53.88 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 108.164 -1.051 . . . . 0.0 108.164 172.648 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.405 HD22 ' HA ' ' A' ' 26' ' ' LEU . 0.2 OUTLIER -107.05 88.41 3.7 Favored Pre-proline 0 C--N 1.327 -0.391 0 C-N-CA 128.844 2.858 . . . . 0.0 112.786 -170.956 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -66.39 120.79 7.96 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 122.194 1.929 . . . . 0.0 111.28 174.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -111.99 107.78 16.87 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 126.805 2.042 . . . . 0.0 106.074 168.102 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 4.4 mtt-85 -59.73 -49.55 77.29 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.093 0.557 . . . . 0.0 110.206 178.151 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 22.3 p -140.4 174.68 10.28 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 123.348 0.659 . . . . 0.0 109.642 178.776 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -56.55 -36.41 69.24 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 124.543 1.137 . . . . 0.0 111.479 178.391 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.5 -30.93 71.97 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-N 118.959 0.8 . . . . 0.0 110.177 -177.617 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -69.1 -40.6 78.3 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-N 119.43 1.014 . . . . 0.0 111.197 174.086 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 13.0 t-105 -56.7 -43.32 80.4 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.254 0.622 . . . . 0.0 110.514 175.128 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -62.6 -55.95 22.36 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 174.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.78 -24.72 67.02 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 124.085 0.954 . . . . 0.0 112.726 -173.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -58.49 -63.78 1.16 Allowed 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 124.6 1.16 . . . . 0.0 109.159 172.679 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 11.6 t -66.29 -30.83 71.33 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 118.606 0.639 . . . . 0.0 110.971 -177.533 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.75 -2.57 15.09 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-O 118.114 -0.946 . . . . 0.0 111.536 176.759 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -129.06 37.47 4.06 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.754 1.222 . . . . 0.0 111.548 169.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 32.1 t 70.86 -80.2 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.428 1.491 . . . . 0.0 110.003 -179.49 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 29.2 mmtm 44.35 56.25 5.08 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 126.033 1.733 . . . . 0.0 112.15 -178.525 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 69.4 -164.35 0.18 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.176 0.99 . . . . 0.0 110.31 171.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.2 mp -97.16 -175.76 3.33 Favored 'General case' 0 CA--C 1.53 0.18 0 O-C-N 121.271 -0.893 . . . . 0.0 110.368 -170.534 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 56.6 mt -130.35 128.12 40.81 Favored 'General case' 0 N--CA 1.456 -0.144 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 166.632 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -118.53 140.96 49.05 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 125.223 1.409 . . . . 0.0 108.363 -179.14 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.563 ' HA ' HD13 ' A' ' 61' ' ' LEU . 43.1 m-85 -63.79 108.99 1.58 Allowed 'General case' 0 C--O 1.234 0.259 0 N-CA-C 107.051 -1.463 . . . . 0.0 107.051 170.741 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 131.8 -12.58 5.36 Favored Glycine 0 CA--C 1.527 0.791 0 CA-C-O 118.919 -0.934 . . . . 0.0 112.866 -178.335 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -60.22 -10.76 4.93 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 127.134 2.173 . . . . 0.0 115.914 -166.349 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.6 ttmt 54.18 124.31 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 129.763 3.225 . . . . 0.0 114.786 175.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 51' ' ' LEU . 1.3 mm? -99.62 149.94 22.76 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 161.217 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 24.1 t -128.98 152.3 36.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 C-N-CA 128.327 2.651 . . . . 0.0 105.189 164.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -133.5 179.41 6.23 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.216 1.406 . . . . 0.0 110.86 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.4 m -70.28 -10.69 59.68 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 178.459 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 62.8 m-80 -85.94 -3.46 58.93 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 124.347 1.059 . . . . 0.0 111.356 170.486 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 60.55 23.25 12.96 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.226 1.01 . . . . 0.0 110.157 -170.22 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 49.2 m170 -75.34 114.42 13.86 Favored 'General case' 0 C--O 1.232 0.176 0 O-C-N 120.655 -1.278 . . . . 0.0 109.035 167.043 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 23.2 m -78.43 153.17 31.72 Favored 'General case' 0 C--O 1.239 0.5 0 N-CA-C 108.334 -0.988 . . . . 0.0 108.334 169.15 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -139.45 152.26 46.88 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.759 1.624 . . . . 0.0 107.861 171.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 63.0 t -136.29 144.25 33.52 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 127.848 2.459 . . . . 0.0 106.927 175.133 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.563 HD13 ' HA ' ' A' ' 47' ' ' TYR . 0.5 OUTLIER -81.02 134.41 35.67 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 127.331 2.252 . . . . 0.0 110.034 -178.493 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -109.97 168.48 9.4 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.729 1.15 . . . . 0.0 111.594 174.584 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -61.3 -15.09 31.92 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 120.384 -1.447 . . . . 0.0 112.876 178.733 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.05 -2.0 22.47 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 126.591 1.957 . . . . 0.0 112.63 171.66 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 74.4 -12.16 0.93 Allowed 'General case' 0 C--N 1.346 0.427 0 C-N-CA 127.009 2.124 . . . . 0.0 111.653 -175.058 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -75.21 156.86 35.35 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 119.348 0.976 . . . . 0.0 112.054 177.753 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 65.9 m95 -104.08 96.19 6.49 Favored 'General case' 0 N--CA 1.436 -1.139 0 N-CA-C 105.211 -2.144 . . . . 0.0 105.211 174.529 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -81.54 161.26 62.34 Favored Pre-proline 0 C--O 1.239 0.543 0 C-N-CA 124.06 0.944 . . . . 0.0 109.847 177.914 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -74.34 148.95 39.28 Favored 'Trans proline' 0 N--CA 1.449 -1.095 0 C-N-CA 122.722 2.281 . . . . 0.0 109.136 -175.29 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -138.89 37.03 2.16 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.172 0.989 . . . . 0.0 110.757 -171.211 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 65.32 164.42 0.12 Allowed Pre-proline 0 CA--C 1.541 0.618 0 C-N-CA 129.001 2.92 . . . . 0.0 113.096 -174.821 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -69.97 -178.6 2.5 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 121.758 1.638 . . . . 0.0 111.699 169.245 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.9 tt -128.38 143.72 49.24 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 125.775 1.63 . . . . 0.0 108.858 -172.647 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -82.87 164.96 15.59 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.679 2.919 . . . . 0.0 111.155 -176.649 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -60.07 -28.32 86.78 Favored 'Trans proline' 0 CA--C 1.535 0.565 0 C-N-CA 121.612 1.542 . . . . 0.0 113.15 -178.13 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -84.24 -20.52 32.1 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.66 0.784 . . . . 0.0 112.731 175.679 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.65 -26.66 70.02 Favored Glycine 0 C--N 1.341 0.82 0 CA-C-N 119.154 0.888 . . . . 0.0 111.371 -173.347 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 18.5 tp -61.23 -52.3 65.35 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 126.391 1.876 . . . . 0.0 108.418 175.041 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -62.93 -34.95 78.54 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 123.128 0.571 . . . . 0.0 109.969 179.313 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.65 -32.44 73.76 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 127.055 2.142 . . . . 0.0 112.566 178.924 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.5 mp -67.07 -66.69 0.53 Allowed 'General case' 0 C--O 1.233 0.208 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 165.332 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 12.7 mm -53.65 -29.46 17.42 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 C-N-CA 125.941 1.697 . . . . 0.0 112.048 -171.103 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.7 mtp180 -44.82 -46.7 10.83 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 126.312 1.845 . . . . 0.0 110.979 173.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.74 -47.09 85.07 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.947 0.794 . . . . 0.0 111.637 179.498 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.466 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 7.0 t60 -59.45 -49.36 78.1 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.872 0.869 . . . . 0.0 109.822 179.547 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 84.8 m -69.17 -26.53 64.9 Favored 'General case' 0 C--N 1.329 -0.287 0 O-C-N 120.972 -1.08 . . . . 0.0 111.307 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -78.41 -14.74 59.25 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.469 1.108 . . . . 0.0 113.427 177.137 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.5 t -98.37 -16.86 19.14 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.968 0.804 . . . . 0.0 111.488 178.632 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 86.8 mt -109.41 -41.49 4.6 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.468 1.107 . . . . 0.0 110.84 178.432 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 103.83 64.8 0.69 Allowed Glycine 0 C--N 1.334 0.426 0 C-N-CA 125.093 1.33 . . . . 0.0 111.428 -178.624 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 10.1 m-70 -130.44 171.77 12.61 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 122.373 1.082 . . . . 0.0 111.46 177.491 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.8 p -146.36 160.02 42.6 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 126.101 1.76 . . . . 0.0 107.064 167.544 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.658 ' H ' ' CD2' ' A' ' 98' ' ' HIS 0.464 0.5 OUTLIER -122.39 158.27 30.05 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 125.697 1.599 . . . . 0.0 108.148 165.939 . . . . . . . . 4 4 . 1 . 018 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 3.4 t -155.29 -44.23 0.08 Allowed 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 -179.447 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 15.0 m -50.43 101.38 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.466 1.507 . . . . 0.0 111.478 179.711 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.508 ' HE2' ' CD2' ' A' ' 100' ' ' HIS . 64.4 tttt 58.81 75.32 0.4 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.204 1.402 . . . . 0.0 110.5 -171.592 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 7.4 tpt 52.65 54.91 9.81 Favored 'General case' 0 CA--C 1.527 0.086 0 C-N-CA 126.907 2.083 . . . . 0.0 111.502 168.648 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' HIS . . . . . 0.658 ' CD2' ' H ' ' A' ' 93' ' ' CYS . 5.7 m80 60.06 -80.58 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 -167.816 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 95.3 mt -133.59 104.91 6.59 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.427 1.491 . . . . 0.0 109.186 -164.541 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' HIS . . . . . 0.508 ' CD2' ' HE2' ' A' ' 96' ' ' LYS . 2.0 t-80 -45.53 -40.7 8.9 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 127.877 2.471 . . . . 0.0 114.691 178.367 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 34.6 t -161.16 165.94 28.68 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 -168.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.683 HG13 HD21 ' A' ' 16' ' ' LEU . 45.5 t -61.64 -42.88 95.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 175.513 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 4.5 ttm -56.51 -44.89 81.17 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 123.752 0.821 . . . . 0.0 111.58 177.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.54 -38.42 87.1 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 110.395 -0.224 . . . . 0.0 110.395 177.865 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.98 -36.32 74.67 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 118.302 -0.856 . . . . 0.0 112.269 175.38 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.4 mm -57.46 -57.72 9.01 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.13 0 CA-C-N 119.389 0.995 . . . . 0.0 108.629 177.228 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.65 -20.97 52.88 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 118.64 0.655 . . . . 0.0 112.677 -169.416 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -55.94 -61.64 2.24 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 164.001 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 73.1 mt -63.57 -37.44 87.33 Favored 'General case' 0 C--O 1.232 0.141 0 C-N-CA 122.725 0.41 . . . . 0.0 110.699 -175.877 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -64.34 -17.6 63.86 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -176.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -100.38 -5.66 26.91 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.735 1.214 . . . . 0.0 113.462 -179.044 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 62.7 mt -67.57 -39.42 84.9 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.58 0.627 . . . . 0.0 110.479 173.43 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -74.86 169.26 18.28 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 126.434 1.894 . . . . 0.0 109.945 170.323 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.052 0 CA-C-O 117.688 -1.618 . . . . 0.0 112.371 166.704 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 ptp . . . . . 0 N--CA 1.473 0.695 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -113.25 132.1 10.44 Favored Glycine 0 CA--C 1.523 0.571 0 C-N-CA 125.68 1.61 . . . . 0.0 109.773 179.489 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -165.93 158.51 14.9 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 128.51 2.724 . . . . 0.0 106.194 175.694 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 146.05 -72.48 0.33 Allowed Glycine 0 CA--C 1.522 0.52 0 CA-C-O 119.015 -0.881 . . . . 0.0 112.206 -173.196 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -122.96 17.21 10.1 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.691 1.596 . . . . 0.0 111.308 -173.585 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -52.37 144.88 21.49 Favored Pre-proline 0 CA--C 1.536 0.425 0 C-N-CA 126.085 1.754 . . . . 0.0 109.297 172.458 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -64.59 -31.88 59.34 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 121.76 1.64 . . . . 0.0 111.512 -177.766 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -160.58 156.42 22.27 Favored Pre-proline 0 CA--C 1.538 0.503 0 CA-C-O 117.537 -1.22 . . . . 0.0 108.916 178.269 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -83.71 -25.14 2.56 Favored 'Trans proline' 0 CA--C 1.536 0.59 0 C-N-CA 122.566 2.178 . . . . 0.0 112.959 171.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -64.84 -18.71 65.37 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.55 1.068 . . . . 0.0 111.703 170.445 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 tt -77.81 123.24 26.48 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.161 0.984 . . . . 0.0 109.18 175.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.1 mm -123.59 108.57 21.2 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 N-CA-C 106.625 -1.62 . . . . 0.0 106.625 -179.451 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 82.6 m95 -53.83 155.49 5.94 Favored Pre-proline 0 C--O 1.237 0.431 0 C-N-CA 124.983 1.313 . . . . 0.0 113.427 -177.158 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -68.42 169.37 57.24 Favored 'Cis proline' 0 CA--C 1.534 0.493 0 N-CA-C 113.965 0.717 . . . . 0.0 113.965 -2.348 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -137.21 168.39 19.71 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 123.846 0.858 . . . . 0.0 110.79 177.216 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 14.3 mt -136.73 108.91 7.24 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 126.805 2.042 . . . . 0.0 107.242 -175.544 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.7 tp -81.01 144.36 31.84 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.633 -0.876 . . . . 0.0 108.633 174.232 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.15 94.06 2.41 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-N 118.571 0.623 . . . . 0.0 109.77 168.907 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -57.09 149.89 18.41 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 121.246 0.546 . . . . 0.0 110.328 -179.63 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -64.08 -10.04 19.94 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 171.154 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -109.06 0.5 31.52 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 125.831 1.681 . . . . 0.0 114.299 -175.91 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -142.82 178.41 7.67 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 120.176 1.988 . . . . 0.0 110.944 177.836 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.437 ' HB3' ' HB1' ' A' ' 84' ' ' ALA . 13.4 m-80 -121.66 -14.07 8.22 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 124.761 1.225 . . . . 0.0 109.163 176.39 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -65.71 117.16 7.74 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 107.467 -1.308 . . . . 0.0 107.467 175.567 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.546 ' HG ' HD13 ' A' ' 82' ' ' ILE . 3.6 mm? -74.41 136.83 42.39 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 106.897 -1.52 . . . . 0.0 106.897 168.946 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -110.34 87.03 5.8 Favored Pre-proline 0 C--O 1.237 0.399 0 C-N-CA 125.704 1.602 . . . . 0.0 108.491 -173.131 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -65.31 136.65 48.14 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 123.454 2.769 . . . . 0.0 110.049 -178.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.5 mt -132.93 98.26 4.25 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 -178.496 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.9 mmt85 -50.96 -44.11 60.51 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.487 1.515 . . . . 0.0 111.317 -177.095 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 14.4 t -160.9 -177.59 6.24 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 121.444 0.64 . . . . 0.0 109.385 -177.921 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -50.38 -38.83 44.66 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 125.537 1.535 . . . . 0.0 110.886 175.644 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -62.35 -33.02 73.9 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.941 0.897 . . . . 0.0 112.243 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.12 -40.15 75.04 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 121.393 -0.817 . . . . 0.0 109.607 174.509 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 47.6 t-105 -63.39 -34.03 76.84 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.214 0.606 . . . . 0.0 111.303 175.57 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -59.63 -62.24 2.03 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 169.544 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 13.2 mtt85 -63.27 -14.4 49.01 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 124.138 0.975 . . . . 0.0 113.548 -174.841 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -64.34 -76.1 0.07 Allowed 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 119.787 1.176 . . . . 0.0 108.608 174.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 1.5 m -61.64 -32.22 72.36 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 118.003 0.365 . . . . 0.0 111.443 -178.238 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.28 -4.76 35.17 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-O 116.661 -1.638 . . . . 0.0 112.243 179.409 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -136.24 -10.49 1.96 Allowed 'General case' 0 C--N 1.347 0.46 0 N-CA-C 116.743 2.127 . . . . 0.0 116.743 173.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 5.7 m -148.18 105.05 3.59 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 127.775 2.43 . . . . 0.0 107.139 169.18 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 2.1 pttt -75.51 59.7 1.13 Allowed 'General case' 0 C--O 1.232 0.154 0 C-N-CA 125.072 1.349 . . . . 0.0 108.438 173.686 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -52.24 148.21 6.77 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 126.341 1.856 . . . . 0.0 108.507 179.215 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.8 tt -61.23 127.66 32.62 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 106.328 -1.731 . . . . 0.0 106.328 173.815 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.4 mt -114.18 137.69 51.42 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 178.845 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 -143.54 151.57 40.39 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 124.259 1.024 . . . . 0.0 111.276 -167.258 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -63.81 115.94 5.29 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 168.518 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 118.93 -0.17 14.95 Favored Glycine 0 CA--C 1.527 0.835 0 CA-C-O 118.71 -1.05 . . . . 0.0 113.136 -173.027 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -65.32 -20.62 66.49 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 115.627 1.714 . . . . 0.0 115.627 -164.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 10.5 ttmt 44.49 137.08 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 131.385 3.874 . . . . 0.0 117.26 178.722 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 14.3 mt -125.65 161.94 26.12 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 114.804 -1.089 . . . . 0.0 109.392 167.503 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 95.2 t -132.38 151.78 35.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 105.533 -2.025 . . . . 0.0 105.533 158.319 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -125.51 -179.47 4.64 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 126.201 1.8 . . . . 0.0 110.828 179.079 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.3 m -64.69 -17.2 63.88 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 178.757 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 31.9 m120 -77.03 -10.71 59.55 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 117.995 -1.002 . . . . 0.0 111.964 171.053 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 64.76 21.55 12.4 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 125.657 1.583 . . . . 0.0 111.658 -167.437 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 52.3 m170 -74.53 110.32 8.73 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 106.435 -1.691 . . . . 0.0 106.435 167.495 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 58.6 m -71.79 151.81 43.2 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 165.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 46.1 m-85 -143.33 160.67 40.1 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 126.461 1.905 . . . . 0.0 108.076 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 2.2 p -154.92 152.34 9.43 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.341 0 CA-C-N 120.741 1.609 . . . . 0.0 111.372 169.481 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 17.1 tp -77.98 144.01 37.11 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 125.396 1.478 . . . . 0.0 108.215 -179.32 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -120.67 168.19 11.66 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 125.559 1.544 . . . . 0.0 110.062 -172.397 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -59.64 -31.15 69.25 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 125.321 1.449 . . . . 0.0 110.841 178.448 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.2 2.87 11.95 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 123.619 0.767 . . . . 0.0 112.473 175.028 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 55.51 18.77 2.84 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 128.937 2.895 . . . . 0.0 113.755 176.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -84.82 -177.16 6.51 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 124.659 1.184 . . . . 0.0 108.549 154.764 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 50.6 m95 -112.31 154.54 25.54 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 171.026 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -124.7 150.85 66.68 Favored Pre-proline 0 C--O 1.236 0.374 0 C-N-CA 124.925 1.29 . . . . 0.0 110.221 175.686 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -71.24 111.79 3.17 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 123.75 2.967 . . . . 0.0 109.99 176.802 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.46 34.87 0.33 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.685 1.194 . . . . 0.0 110.807 171.326 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.83 166.64 0.12 Allowed Pre-proline 0 CA--C 1.545 0.785 0 C-N-CA 125.927 1.691 . . . . 0.0 112.131 -179.695 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -70.57 176.22 7.69 Favored 'Trans proline' 0 CA--C 1.535 0.571 0 C-N-CA 121.219 1.279 . . . . 0.0 111.076 166.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 20.6 tp -131.43 144.58 54.01 Favored Pre-proline 0 CA--C 1.536 0.441 0 C-N-CA 125.616 1.566 . . . . 0.0 109.324 -174.053 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -77.14 168.19 23.64 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 122.416 2.078 . . . . 0.0 109.555 176.679 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -59.05 -47.08 19.05 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 122.275 1.983 . . . . 0.0 112.367 178.756 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -79.16 -6.08 55.71 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 119.482 1.037 . . . . 0.0 110.108 -177.224 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.6 -24.45 67.92 Favored Glycine 0 CA--C 1.534 1.243 0 CA-C-O 118.841 -0.977 . . . . 0.0 112.972 164.021 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 25.6 tp -59.2 -48.08 82.94 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.588 1.694 . . . . 0.0 108.916 178.636 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -67.51 -7.5 26.3 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 125.421 1.488 . . . . 0.0 112.34 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -82.69 -34.94 27.2 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 121.148 1.795 . . . . 0.0 111.251 168.794 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -66.96 -70.76 0.23 Allowed 'General case' 0 N--CA 1.457 -0.114 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 178.19 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.546 HD13 ' HG ' ' A' ' 25' ' ' LEU . 34.0 mm -57.53 -21.03 15.02 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 C-N-CA 123.102 0.561 . . . . 0.0 112.219 -174.95 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.87 -47.84 11.13 Favored 'General case' 0 C--N 1.343 0.286 0 C-N-CA 124.3 1.04 . . . . 0.0 111.716 172.159 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.437 ' HB1' ' HB3' ' A' ' 23' ' ' ASN . . . -65.79 -48.85 70.38 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.23 0.612 . . . . 0.0 109.952 -171.66 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.526 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 10.5 t60 -55.31 -49.32 72.46 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 126.036 1.734 . . . . 0.0 110.01 175.713 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 90.0 m -61.64 -46.41 89.89 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.463 179.063 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.55 -40.4 94.56 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 118.877 0.762 . . . . 0.0 112.33 -178.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.4 t -78.59 7.0 7.46 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.025 0.53 . . . . 0.0 111.753 178.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.5 mt -126.83 -21.99 3.94 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.005 -1.059 . . . . 0.0 111.35 173.01 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 97.9 6.8 56.91 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 126.378 1.942 . . . . 0.0 113.997 -176.714 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 81.3 m-70 -76.96 163.15 26.98 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-N 119.404 1.602 . . . . 0.0 110.71 -174.093 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 42.5 t -157.09 97.83 1.69 Allowed 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.653 1.181 . . . . 0.0 108.053 171.366 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 27.1 p 46.91 -167.83 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.246 1.819 . . . . 0.0 114.4 175.673 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.447 HG23 ' H ' ' A' ' 95' ' ' SER . 1.2 t -167.61 -85.36 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 105.299 -2.112 . . . . 0.0 105.299 -177.631 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' SER . . . . . 0.447 ' H ' HG23 ' A' ' 94' ' ' THR . 2.5 m -93.06 172.36 8.36 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.587 1.155 . . . . 0.0 109.987 168.661 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . 0.43 0.0 OUTLIER 45.27 -164.91 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 128.62 2.768 . . . . 0.0 114.846 169.075 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -72.63 55.79 0.37 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 127.057 2.143 . . . . 0.0 109.167 176.3 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER 65.2 -54.1 0.33 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 127.778 2.431 . . . . 0.0 112.705 -165.684 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 95.0 mt -145.39 171.44 14.61 Favored 'General case' 0 C--O 1.225 -0.184 0 C-N-CA 127.478 2.311 . . . . 0.0 108.503 -166.655 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 27.2 t-80 -131.06 -29.56 1.84 Allowed 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 125.066 1.346 . . . . 0.0 110.135 -172.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 5.1 m -173.45 170.53 4.15 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.731 1.612 . . . . 0.0 108.681 -175.771 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 70.5 t -59.62 -44.0 92.39 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 172.149 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 3.4 tpt -47.34 -54.35 11.32 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.12 0.968 . . . . 0.0 109.377 174.9 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.63 -29.56 70.78 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.536 0.734 . . . . 0.0 112.184 -175.572 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -69.61 -48.67 59.29 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.553 1.141 . . . . 0.0 110.417 175.219 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 11.5 mm -59.74 -32.66 50.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 123.99 0.916 . . . . 0.0 109.723 178.665 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -69.0 -50.15 51.44 Favored 'General case' 0 C--N 1.338 0.091 0 C-N-CA 123.501 0.72 . . . . 0.0 110.437 175.57 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -54.84 -60.81 2.86 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 125.92 1.688 . . . . 0.0 111.105 178.259 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.8 mp -52.24 -40.92 62.29 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.412 1.085 . . . . 0.0 112.627 -179.242 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 20.5 m-80 -72.45 -28.54 63.0 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 118.881 0.764 . . . . 0.0 112.718 176.202 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -76.95 -27.53 54.85 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 121.353 -0.842 . . . . 0.0 111.296 177.028 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 40.5 mt -64.79 -53.43 47.06 Favored 'General case' 0 CA--C 1.522 -0.107 0 C-N-CA 123.656 0.782 . . . . 0.0 109.401 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.28 136.57 57.37 Favored 'General case' 0 C--O 1.242 0.688 0 CA-C-O 121.765 0.793 . . . . 0.0 110.706 -176.84 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.934 0 CA-C-O 116.184 -2.453 . . . . 0.0 109.881 168.618 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.472 0.629 0 CA-C-O 118.6 -0.714 . . . . 0.0 112.55 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -172.83 -171.56 37.7 Favored Glycine 0 C--N 1.337 0.603 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 176.651 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -78.43 72.67 4.97 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.816 0.846 . . . . 0.0 108.752 170.635 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -133.05 -168.3 11.91 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 125.667 1.604 . . . . 0.0 110.465 -179.016 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -124.24 84.73 2.31 Favored 'General case' 0 CA--C 1.528 0.135 0 CA-C-O 122.252 1.025 . . . . 0.0 108.594 179.574 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.43 144.29 35.5 Favored Pre-proline 0 C--O 1.24 0.577 0 C-N-CA 127.32 2.248 . . . . 0.0 109.863 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -65.59 -47.42 4.11 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 122.262 1.975 . . . . 0.0 111.881 -177.704 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -146.58 145.94 25.15 Favored Pre-proline 0 C--O 1.234 0.281 0 N-CA-C 106.745 -1.576 . . . . 0.0 106.745 170.31 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -73.96 -34.6 5.01 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.15 1.9 . . . . 0.0 111.348 175.89 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -76.29 -7.75 55.6 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.994 1.317 . . . . 0.0 113.062 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.664 HD21 ' HB2' ' A' ' 15' ' ' ALA . 5.1 tt -60.05 107.73 0.67 Allowed 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.236 1.015 . . . . 0.0 108.742 170.411 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 33.3 mm -83.9 100.2 7.13 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 172.23 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 64.5 m95 -56.14 155.31 12.82 Favored Pre-proline 0 CA--C 1.544 0.72 0 O-C-N 121.486 -0.759 . . . . 0.0 111.696 178.433 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -67.79 169.34 53.82 Favored 'Cis proline' 0 N--CA 1.459 -0.544 0 C-N-CA 125.425 -0.656 . . . . 0.0 113.468 -4.377 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.664 ' HB2' HD21 ' A' ' 11' ' ' LEU . . . -135.64 170.24 16.28 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.515 0.726 . . . . 0.0 111.059 176.293 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 mt -136.96 106.9 6.27 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 126.951 2.1 . . . . 0.0 106.203 178.618 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.3 tp -70.26 146.87 50.34 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 105.597 -2.001 . . . . 0.0 105.597 161.645 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.27 88.48 2.02 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 173.861 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -61.41 158.11 15.38 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 123.1 1.428 . . . . 0.0 112.417 -158.732 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.27 134.93 40.98 Favored 'General case' 0 N--CA 1.431 -1.416 0 N-CA-C 105.598 -2.001 . . . . 0.0 105.598 178.908 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 88.69 -54.79 4.11 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 125.162 1.363 . . . . 0.0 111.137 -175.046 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -80.09 -13.65 59.12 Favored 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 115.327 1.603 . . . . 0.0 115.327 -159.521 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.507 ' HB3' ' HB1' ' A' ' 84' ' ' ALA . 6.5 m-80 64.47 -20.18 0.07 Allowed 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 121.664 2.029 . . . . 0.0 114.298 175.33 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -73.48 154.81 39.76 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 127.665 2.386 . . . . 0.0 109.525 178.757 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.9 mt -104.17 155.23 18.89 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 125.262 1.425 . . . . 0.0 109.147 -178.382 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -124.5 86.36 55.31 Favored Pre-proline 0 CA--C 1.538 0.506 0 C-N-CA 124.997 1.319 . . . . 0.0 108.975 177.014 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -68.68 114.82 3.65 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 124.509 3.473 . . . . 0.0 111.512 -177.667 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.8 mt -116.62 104.9 11.85 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 124.997 1.319 . . . . 0.0 108.447 -173.143 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -58.57 -44.7 89.85 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.22 0.533 . . . . 0.0 111.737 -177.288 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.3 p -151.44 174.47 13.33 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 124.878 1.271 . . . . 0.0 108.937 -162.301 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -69.38 -27.76 65.6 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 119.921 -0.712 . . . . 0.0 111.604 174.764 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -56.55 -32.8 65.49 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.298 0.954 . . . . 0.0 110.131 169.048 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -68.27 -42.98 78.79 Favored 'General case' 0 C--O 1.223 -0.302 0 O-C-N 120.988 -1.07 . . . . 0.0 110.05 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 31.3 t-105 -59.53 -32.19 70.08 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.514 -0.741 . . . . 0.0 112.02 174.699 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -65.12 -56.44 12.94 Favored 'General case' 0 CA--C 1.52 -0.178 0 O-C-N 121.067 -1.021 . . . . 0.0 109.057 175.202 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 87.3 mtm180 -57.14 -43.1 82.11 Favored 'General case' 0 C--O 1.221 -0.414 0 C-N-CA 124.073 0.949 . . . . 0.0 110.259 -179.415 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -50.26 -49.92 51.75 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 124.995 1.318 . . . . 0.0 112.38 174.765 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 8.9 t -74.27 -27.23 60.64 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 118.882 0.765 . . . . 0.0 111.527 -178.341 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.11 -41.72 70.22 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 118.686 0.676 . . . . 0.0 111.634 174.387 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -124.18 1.45 8.51 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -154.906 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 43.9 t -133.95 -72.08 0.5 Allowed 'General case' 0 C--O 1.234 0.26 0 C-N-CA 124.184 0.994 . . . . 0.0 108.756 174.428 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.7 ptmt 44.2 45.11 6.91 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 125.898 1.679 . . . . 0.0 113.254 177.096 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -68.76 66.26 0.13 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.669 1.988 . . . . 0.0 109.468 169.5 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.3 mp 49.61 -176.58 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 127.016 2.127 . . . . 0.0 112.977 -176.404 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 67.5 mt -143.03 127.08 17.39 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 106.375 -1.713 . . . . 0.0 106.375 161.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 -109.52 149.11 30.1 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 172.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.417 ' HA ' ' HB3' ' A' ' 61' ' ' LEU . 24.2 m-85 -70.16 70.62 0.39 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 126.674 1.99 . . . . 0.0 110.016 -178.181 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 160.76 2.97 0.06 OUTLIER Glycine 0 N--CA 1.439 -1.108 0 C-N-CA 123.553 0.597 . . . . 0.0 112.003 -172.475 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -65.35 -10.2 31.07 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 -172.412 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.7 ttmt 60.05 140.75 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 129.228 3.011 . . . . 0.0 111.997 174.779 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 5.7 mt -130.73 154.77 47.61 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 106.538 -1.653 . . . . 0.0 106.538 167.318 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 53.2 t -136.79 122.33 27.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 102.687 -3.079 . . . . 0.0 102.687 173.201 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -82.03 -165.54 1.02 Allowed 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 127.965 2.506 . . . . 0.0 112.486 167.46 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 83.6 p -73.06 -29.86 63.28 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 120.254 1.388 . . . . 0.0 114.043 176.18 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -83.18 1.47 40.44 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 126.224 1.81 . . . . 0.0 111.259 -168.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 65.46 22.7 11.89 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.615 1.966 . . . . 0.0 111.364 -173.599 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -66.76 112.49 4.26 Favored 'General case' 0 C--O 1.232 0.152 0 O-C-N 120.381 -1.449 . . . . 0.0 109.934 161.213 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 11.4 m -69.35 158.28 35.38 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 119.956 -0.698 . . . . 0.0 109.36 161.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -141.75 166.1 25.65 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 125.518 1.527 . . . . 0.0 109.445 172.294 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 34.1 t -144.46 134.44 19.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 C-N-CA 127.141 2.176 . . . . 0.0 107.209 177.084 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.417 ' HB3' ' HA ' ' A' ' 47' ' ' TYR . 0.2 OUTLIER -78.79 135.6 37.13 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 106.605 -1.628 . . . . 0.0 106.605 167.056 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -120.02 170.61 9.12 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 119.751 1.159 . . . . 0.0 111.92 174.112 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -54.91 -17.29 3.48 Favored 'General case' 0 N--CA 1.468 0.467 0 O-C-N 121.034 -1.041 . . . . 0.0 112.865 175.288 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -72.51 -5.29 35.94 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.551 1.14 . . . . 0.0 113.592 173.697 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 68.89 6.78 5.79 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 126.683 1.993 . . . . 0.0 112.574 -176.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -95.12 162.47 13.7 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 119.396 0.998 . . . . 0.0 111.667 171.648 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 56.5 m95 -107.51 78.7 1.23 Allowed 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 124.979 1.312 . . . . 0.0 108.59 178.69 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 63.0 t-80 -60.7 144.09 89.92 Favored Pre-proline 0 CA--C 1.545 0.75 0 CA-C-O 119.136 -0.459 . . . . 0.0 110.187 -171.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.82 113.23 3.48 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 124.103 3.202 . . . . 0.0 111.097 173.729 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -94.13 40.43 1.08 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.857 1.663 . . . . 0.0 111.24 -179.107 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.91 165.25 0.13 Allowed Pre-proline 0 CA--C 1.543 0.677 0 C-N-CA 127.856 2.462 . . . . 0.0 113.485 175.806 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -68.16 171.21 12.99 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.726 2.284 . . . . 0.0 112.025 167.467 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.0 tp -146.95 146.15 24.96 Favored Pre-proline 0 CA--C 1.534 0.335 0 C-N-CA 124.121 0.968 . . . . 0.0 111.41 -170.253 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -64.75 164.47 24.1 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 123.138 2.558 . . . . 0.0 113.384 171.591 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -61.17 -28.75 85.74 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 123.806 3.004 . . . . 0.0 112.809 174.736 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -82.51 -16.99 46.69 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 121.803 -0.561 . . . . 0.0 110.941 -179.393 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.93 -32.18 80.21 Favored Glycine 0 CA--C 1.534 1.263 0 N-CA-C 110.926 -0.87 . . . . 0.0 110.926 177.031 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 23.0 tp -58.71 -52.61 64.94 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.001 -1.293 . . . . 0.0 110.059 169.697 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -52.39 -27.33 15.3 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.885 0.874 . . . . 0.0 113.04 -174.128 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -72.07 -42.13 66.58 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.01 0.924 . . . . 0.0 112.171 178.242 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.5 mp -61.8 -44.83 96.08 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 123.909 0.884 . . . . 0.0 110.696 173.591 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 49.4 mm -55.83 -50.09 70.6 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 C-N-CA 123.713 0.805 . . . . 0.0 108.949 175.429 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.97 -46.19 10.96 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 125.475 1.51 . . . . 0.0 112.448 174.934 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.507 ' HB1' ' HB3' ' A' ' 23' ' ' ASN . . . -58.49 -51.4 70.02 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 123.457 0.473 . . . . 0.0 111.049 -177.156 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 26.5 t60 -61.24 -46.27 91.09 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.469 1.108 . . . . 0.0 110.508 177.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 73.1 m -60.97 -46.31 91.26 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 117.54 -1.219 . . . . 0.0 110.341 -178.001 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.84 -31.11 68.8 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 119.851 1.205 . . . . 0.0 112.22 -176.35 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 15.3 t -73.25 -5.88 42.32 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 117.727 -1.13 . . . . 0.0 111.878 176.46 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 90.0 mt -123.51 -62.33 1.32 Allowed 'General case' 0 C--N 1.342 0.267 0 CA-C-N 120.039 1.29 . . . . 0.0 110.405 -176.687 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 153.61 7.22 0.09 OUTLIER Glycine 0 CA--C 1.537 1.439 0 C-N-CA 126.907 2.194 . . . . 0.0 113.224 176.669 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 15.5 m170 -74.47 151.16 39.61 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 118.645 1.222 . . . . 0.0 109.468 -160.769 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 2.7 p -143.19 26.24 1.67 Allowed 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -161.355 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 1.7 p 57.43 -174.76 0.07 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 127.251 2.22 . . . . 0.0 109.356 -167.245 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 3.1 t -157.21 -47.49 0.07 Allowed 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 175.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.4 p -135.12 161.96 33.85 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 119.547 1.067 . . . . 0.0 109.776 173.506 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 57.28 -167.92 0.12 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.285 1.034 . . . . 0.0 111.631 173.232 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 33.6 ttp -80.02 62.07 4.1 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.498 1.119 . . . . 0.0 109.305 177.7 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 3.5 m80 61.69 -71.88 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.518 1.527 . . . . 0.0 110.006 -161.408 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.491 HD13 ' HB2' ' A' ' 105' ' ' ALA . 81.4 mt -137.28 158.76 43.71 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 125.895 1.678 . . . . 0.0 110.277 -160.815 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -120.22 -20.97 7.14 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 124.062 0.945 . . . . 0.0 110.744 -163.036 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 17.2 m -160.1 173.92 15.08 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 127.177 2.191 . . . . 0.0 108.2 170.714 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 41.0 t -61.11 -40.58 86.23 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.307 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 168.716 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 4.1 ttm -60.79 -41.67 96.04 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 118.513 0.597 . . . . 0.0 110.794 -178.683 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -58.22 -35.03 71.07 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-O 119.187 -0.435 . . . . 0.0 110.869 174.556 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.491 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -65.18 -39.97 93.61 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 118.721 0.691 . . . . 0.0 111.545 179.332 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.7 mm -59.92 -51.62 70.74 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 177.193 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -62.89 -49.26 75.52 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.366 1.066 . . . . 0.0 109.795 -176.414 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -55.26 -52.57 62.97 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 126.621 1.968 . . . . 0.0 111.784 179.465 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 41.2 mt -62.22 -37.78 86.66 Favored 'General case' 0 CA--C 1.523 -0.088 0 CA-C-N 117.679 0.218 . . . . 0.0 110.8 -172.284 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -78.38 -26.36 46.53 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 122.569 0.348 . . . . 0.0 111.38 177.026 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -74.64 -25.83 59.47 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 118.628 -0.701 . . . . 0.0 112.413 174.64 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 13.1 mt -66.34 -48.48 70.1 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 118.931 0.787 . . . . 0.0 110.304 177.022 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -66.71 143.44 56.96 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 122.49 0.316 . . . . 0.0 110.169 -178.648 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.71 0 N-CA-C 106.777 -2.529 . . . . 0.0 106.777 -173.548 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.605 HG22 HD21 ' A' ' 31' ' ' ASN . 44.1 p . . . . . 0 CA--C 1.537 0.449 0 N-CA-C 111.574 0.213 . . . . 0.0 111.574 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -74.11 -55.1 0.09 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.113 0 C-N-CA 120.682 0.921 . . . . 0.0 110.761 -174.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -156.09 144.58 14.58 Favored Pre-proline 0 C--O 1.237 0.414 0 N-CA-C 106.091 -1.818 . . . . 0.0 106.091 -179.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -69.57 -29.52 24.66 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.053 1.835 . . . . 0.0 110.78 174.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -82.38 -15.53 52.39 Favored 'General case' 0 N--CA 1.455 -0.2 0 O-C-N 121.916 -0.49 . . . . 0.0 112.277 -171.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.6 tt -63.0 122.46 16.1 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 170.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 21.0 mm -103.09 109.25 26.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 N-CA-C 107.167 -1.42 . . . . 0.0 107.167 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 85.6 m95 -58.81 156.35 25.52 Favored Pre-proline 0 CA--C 1.542 0.644 0 C-N-CA 124.134 0.974 . . . . 0.0 111.079 179.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -66.92 170.26 45.43 Favored 'Cis proline' 0 N--CA 1.458 -0.604 0 C-N-CA 125.303 -0.707 . . . . 0.0 113.38 -4.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -136.5 168.75 18.88 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.591 0.71 . . . . 0.0 110.678 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 18.9 mt -136.01 103.57 5.4 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 125.826 1.651 . . . . 0.0 108.027 -174.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.5 tp -87.35 143.44 27.25 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 174.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.413 ' HG2' HD22 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -138.11 83.31 1.97 Allowed 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 119.992 1.269 . . . . 0.0 110.373 179.092 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -59.7 155.27 16.15 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 123.439 0.695 . . . . 0.0 111.714 -161.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.13 139.92 58.74 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-O 123.317 1.532 . . . . 0.0 108.694 -176.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 69.12 -33.65 0.31 Allowed Glycine 0 CA--C 1.533 1.177 0 C-N-CA 127.487 2.47 . . . . 0.0 113.805 -175.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 89.8 m -76.18 176.31 8.17 Favored 'General case' 0 C--O 1.24 0.59 0 CA-C-N 120.755 2.277 . . . . 0.0 111.03 177.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.5 m-80 -128.46 -22.52 3.34 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 124.858 1.263 . . . . 0.0 111.465 -176.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -66.37 111.08 3.34 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 107.929 -1.138 . . . . 0.0 107.929 -176.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.604 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 3.2 mm? -60.09 139.14 57.67 Favored 'General case' 0 CA--C 1.512 -0.506 0 N-CA-C 107.208 -1.405 . . . . 0.0 107.208 167.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.421 HD13 ' HA ' ' A' ' 26' ' ' LEU . 0.4 OUTLIER -103.85 87.46 1.53 Allowed Pre-proline 0 C--N 1.324 -0.506 0 N-CA-C 104.579 -2.378 . . . . 0.0 104.579 176.567 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -62.54 140.95 84.42 Favored 'Trans proline' 0 N--CA 1.452 -0.956 0 N-CA-C 108.147 -1.521 . . . . 0.0 108.147 170.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.8 mt -138.5 100.29 4.06 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 104.614 -2.365 . . . . 0.0 104.614 -177.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 63.8 mtt180 -59.09 -35.93 74.24 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 118.352 0.524 . . . . 0.0 111.206 -175.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 15.0 t -161.66 -178.93 6.88 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 123.628 0.771 . . . . 0.0 109.018 -175.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.605 HD21 HG22 ' A' ' 6' ' ' THR . 0.4 OUTLIER -57.84 -28.36 64.03 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 125.497 1.519 . . . . 0.0 112.587 -179.33 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -61.52 -41.16 96.92 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.702 -0.624 . . . . 0.0 109.981 176.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -66.34 -30.84 71.32 Favored 'General case' 0 CA--C 1.522 -0.117 0 C-N-CA 123.783 0.833 . . . . 0.0 110.925 -175.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 63.5 t-105 -74.48 -43.09 57.64 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.671 0.788 . . . . 0.0 111.061 173.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -63.3 -35.44 80.38 Favored 'General case' 0 CA--C 1.528 0.13 0 O-C-N 121.698 -0.627 . . . . 0.0 110.283 176.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 63.2 mtt180 . . . . . 0 CA--C 1.538 0.495 0 C-N-CA 124.511 1.124 . . . . 0.0 112.357 173.204 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.8 mt . . . . . 0 CA--C 1.511 -0.529 0 CA-C-O 122.823 1.297 . . . . 0.0 109.826 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -88.63 152.0 22.11 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 113.779 -1.555 . . . . 0.0 109.577 -175.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.431 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 1.4 m-85 -71.54 93.27 1.19 Allowed 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 173.584 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 141.85 -5.27 2.24 Favored Glycine 0 N--CA 1.443 -0.891 0 CA-C-O 117.824 -1.542 . . . . 0.0 113.816 -163.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.55 -7.49 44.25 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 116.684 2.105 . . . . 0.0 116.684 -164.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.0 tppt? 44.65 130.89 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 131.405 3.882 . . . . 0.0 116.213 -174.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.1 mt -117.52 152.52 34.92 Favored 'General case' 0 C--N 1.331 -0.238 0 O-C-N 120.776 -1.202 . . . . 0.0 107.995 164.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 54.1 t -133.82 141.49 43.92 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 105.817 -1.919 . . . . 0.0 105.817 167.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -109.49 174.84 5.68 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 125.489 1.516 . . . . 0.0 110.448 175.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.2 m -60.89 -17.11 48.69 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -179.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -98.03 11.08 38.75 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.836 1.254 . . . . 0.0 111.308 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 64.54 24.75 13.12 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.023 1.729 . . . . 0.0 111.987 176.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 32.8 m80 -75.65 114.97 14.83 Favored 'General case' 0 C--N 1.332 -0.186 0 O-C-N 120.43 -1.418 . . . . 0.0 107.711 166.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.506 ' SG ' HD13 ' A' ' 73' ' ' LEU . 1.3 m -73.1 153.86 40.63 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 122.129 0.966 . . . . 0.0 108.949 161.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -140.33 157.54 45.39 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 126.359 1.864 . . . . 0.0 106.846 171.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 79.0 t -129.0 148.79 33.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 106.155 -1.794 . . . . 0.0 106.155 167.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 18.3 tp -86.93 144.14 27.08 Favored 'General case' 0 CA--C 1.521 -0.163 0 C-N-CA 125.925 1.69 . . . . 0.0 109.137 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -116.03 165.19 13.4 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 124.402 1.081 . . . . 0.0 110.359 -175.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.431 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 0.1 OUTLIER -68.18 -14.49 63.02 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 173.798 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -81.02 16.14 1.6 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.581 1.553 . . . . 0.0 111.823 173.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 45.78 37.36 3.38 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 126.854 2.062 . . . . 0.0 112.411 -178.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.1 p-80 -125.6 170.28 11.64 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 172.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 62.4 m95 -111.71 127.57 55.82 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 107.203 -1.406 . . . . 0.0 107.203 175.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -97.76 145.79 30.34 Favored Pre-proline 0 CA--C 1.537 0.481 0 C-N-CA 123.975 0.91 . . . . 0.0 108.966 178.201 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.26 116.01 4.52 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 123.376 2.717 . . . . 0.0 110.881 175.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -117.87 57.37 0.83 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.863 1.665 . . . . 0.0 109.568 -170.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.11 156.24 0.14 Allowed Pre-proline 0 CA--C 1.538 0.497 0 C-N-CA 129.731 3.213 . . . . 0.0 114.147 178.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -72.07 169.85 20.4 Favored 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 121.765 1.643 . . . . 0.0 110.355 161.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.506 HD13 ' SG ' ' A' ' 58' ' ' CYS . 11.3 tp -126.21 144.66 49.82 Favored Pre-proline 0 N--CA 1.451 -0.42 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.922 -167.006 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -69.95 165.28 31.72 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 121.614 1.542 . . . . 0.0 111.52 176.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -56.47 -31.11 84.79 Favored 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 123.434 2.756 . . . . 0.0 113.388 174.134 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -81.72 -15.96 52.7 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.278 1.031 . . . . 0.0 112.242 176.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -76.75 -22.15 72.83 Favored Glycine 0 CA--C 1.527 0.794 0 O-C-N 121.763 -0.586 . . . . 0.0 112.104 -174.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 29.7 tp -63.49 -48.53 77.24 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 121.694 -0.886 . . . . 0.0 109.6 164.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -53.86 -37.77 64.0 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 118.695 -0.669 . . . . 0.0 111.479 175.266 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -60.4 -34.38 73.84 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.564 1.075 . . . . 0.0 113.053 177.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.9 mp -67.8 -64.07 0.93 Allowed 'General case' 0 N--CA 1.456 -0.127 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 172.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.9 mm -60.58 -26.96 39.31 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 C-N-CA 123.681 0.792 . . . . 0.0 111.538 -170.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -44.98 -41.62 7.5 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 125.415 1.486 . . . . 0.0 110.905 168.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.56 -63.58 1.09 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.771 1.228 . . . . 0.0 111.522 176.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.604 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 7.4 t60 -55.77 -40.1 72.15 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.368 1.067 . . . . 0.0 111.267 -177.222 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 23.7 m -68.46 -51.81 39.5 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 120.38 -1.45 . . . . 0.0 110.301 177.326 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.74 -33.24 75.42 Favored 'General case' 0 C--N 1.339 0.137 0 CA-C-N 119.099 0.863 . . . . 0.0 111.887 -175.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.3 t -71.13 -28.41 64.27 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 118.403 -0.808 . . . . 0.0 109.302 -176.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 98.1 mt -88.4 -56.68 3.21 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 124.478 1.111 . . . . 0.0 110.858 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 142.99 9.45 0.51 Allowed Glycine 0 CA--C 1.532 1.118 0 CA-C-O 117.96 -1.467 . . . . 0.0 114.38 -172.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 7.3 m-70 . . . . . 0 N--CA 1.464 0.225 0 CA-C-N 120.456 2.128 . . . . 0.0 111.877 -173.562 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.329 0 CA-C-O 118.901 -0.571 . . . . 0.0 110.276 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 77.7 mt -147.4 134.71 20.64 Favored 'General case' 0 CA--C 1.512 -0.499 0 C-N-CA 124.947 1.299 . . . . 0.0 107.664 -174.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 51.9 t-80 -61.92 -48.08 82.05 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 122.04 0.924 . . . . 0.0 110.536 178.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 2.8 m -164.82 -178.17 5.11 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.767 1.227 . . . . 0.0 111.296 -169.07 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 63.2 t -64.54 -38.24 82.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 CA-C-O 118.47 -0.776 . . . . 0.0 110.659 -176.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.01 -50.44 61.37 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 119.257 0.935 . . . . 0.0 109.122 177.002 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -65.53 -36.29 83.36 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.858 1.263 . . . . 0.0 110.307 -175.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.3 -48.5 81.09 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.999 0.519 . . . . 0.0 110.48 176.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 20.2 mm -65.24 -28.35 44.34 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 -178.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -69.8 -48.4 59.27 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.198 -0.939 . . . . 0.0 109.415 173.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -57.79 -65.11 0.69 Allowed 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 125.781 1.632 . . . . 0.0 111.629 -179.344 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.4 mp -49.23 -33.95 13.83 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 126.237 1.815 . . . . 0.0 113.914 -175.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -62.18 -44.99 95.38 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 118.141 0.428 . . . . 0.0 112.049 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -82.52 -8.68 59.61 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -173.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . 0.275 3.2 tp . . . . . 0 N--CA 1.4 -2.948 0 C-N-CA 128.352 2.661 . . . . 0.0 107.51 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 20.6 p . . . . . 0 CA--C 1.535 0.386 0 CA-C-O 118.773 -0.632 . . . . 0.0 110.775 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.98 -55.48 0.31 Allowed 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 120.928 1.086 . . . . 0.0 111.697 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -160.82 143.78 9.69 Favored Pre-proline 0 CA--C 1.534 0.362 0 CA-C-N 119.485 1.039 . . . . 0.0 110.29 -173.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -73.84 -23.49 16.43 Favored 'Trans proline' 0 CA--C 1.531 0.372 0 C-N-CA 121.446 1.431 . . . . 0.0 113.56 -176.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 -72.25 -28.74 63.34 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-O 116.899 -1.524 . . . . 0.0 111.974 172.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.5 tt -56.33 123.59 15.14 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 120.106 1.321 . . . . 0.0 110.939 -173.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 28.0 mm -106.25 97.19 5.31 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.145 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 -177.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.48 ' CH2' ' HB2' ' A' ' 34' ' ' TRP . 81.5 m95 -51.16 144.06 15.63 Favored Pre-proline 0 C--O 1.236 0.391 0 O-C-N 123.761 0.663 . . . . 0.0 111.057 174.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -75.87 169.71 73.77 Favored 'Cis proline' 0 N--CA 1.458 -0.58 0 N-CA-C 114.142 0.785 . . . . 0.0 114.142 8.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -138.02 171.33 14.57 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 121.282 0.563 . . . . 0.0 111.496 175.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 19.3 mt -137.58 109.17 6.99 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 125.966 1.706 . . . . 0.0 108.067 -173.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 13.4 tp -94.41 137.79 33.13 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.549 1.139 . . . . 0.0 108.678 175.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -130.88 84.89 2.22 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.678 1.126 . . . . 0.0 110.959 179.342 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -46.21 132.43 9.88 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 126.982 2.113 . . . . 0.0 110.004 -175.237 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -60.71 127.68 32.84 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 122.601 1.191 . . . . 0.0 110.117 177.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 99.06 -49.53 1.23 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 126.295 1.902 . . . . 0.0 110.106 -174.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 57.1 m -67.99 169.26 10.32 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 122.831 1.3 . . . . 0.0 111.11 -178.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -129.41 -30.59 2.12 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 125.346 1.459 . . . . 0.0 108.935 -178.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -72.83 98.62 2.47 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 126.538 1.935 . . . . 0.0 108.579 -172.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.489 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 2.0 mm? -53.87 152.29 5.71 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 123.638 0.775 . . . . 0.0 110.918 -173.365 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -105.54 86.61 1.82 Allowed Pre-proline 0 C--O 1.235 0.306 0 C-N-CA 124.907 1.283 . . . . 0.0 108.197 172.26 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -66.94 142.74 63.51 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 121.832 1.688 . . . . 0.0 109.139 168.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.7 mt -145.86 109.32 4.71 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 -179.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.8 mmt85 -60.04 -47.7 84.75 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 123.644 0.777 . . . . 0.0 110.571 -176.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 45.3 p -139.86 174.64 10.31 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 124.135 0.974 . . . . 0.0 109.306 -172.217 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.75 -20.87 66.09 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.96 0.504 . . . . 0.0 111.486 173.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 48.1 m-20 -55.52 -42.5 74.62 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 123.794 0.838 . . . . 0.0 108.766 171.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -81.75 -29.64 32.77 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 123.14 0.576 . . . . 0.0 111.672 -173.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.48 ' HB2' ' CH2' ' A' ' 13' ' ' TRP . 44.7 t-105 -56.88 -45.49 82.49 Favored 'General case' 0 CA--C 1.528 0.129 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 169.537 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 66.2 mm-40 -64.33 -47.65 78.56 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 123.047 0.539 . . . . 0.0 110.367 174.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 28.1 mtt180 . . . . . 0 N--CA 1.475 0.806 0 CA-C-O 118.164 -0.922 . . . . 0.0 113.43 178.166 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 85.2 mt . . . . . 0 N--CA 1.451 -0.382 0 N-CA-C 105.244 -2.132 . . . . 0.0 105.244 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -117.12 152.0 35.65 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 125.469 1.508 . . . . 0.0 108.731 -177.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.428 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 11.7 m-85 -58.06 138.27 56.17 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 107.092 -1.448 . . . . 0.0 107.092 167.311 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.75 3.18 80.79 Favored Glycine 0 CA--C 1.529 0.962 0 CA-C-O 117.55 -1.694 . . . . 0.0 114.872 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -65.97 -10.66 41.37 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 120.231 2.016 . . . . 0.0 115.154 -170.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 53.68 127.92 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 129.67 3.188 . . . . 0.0 115.443 176.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 13.0 mt -113.21 157.24 21.98 Favored 'General case' 0 C--N 1.328 -0.363 0 O-C-N 121.007 -1.058 . . . . 0.0 108.45 165.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 47.7 t -146.05 138.32 20.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 C-N-CA 128.379 2.672 . . . . 0.0 104.146 177.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.8 p-10 -118.15 -179.1 3.67 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 124.725 1.21 . . . . 0.0 111.347 177.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.64 -7.7 16.54 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 177.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -100.75 5.29 43.57 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.787 1.635 . . . . 0.0 111.54 174.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 59.06 20.27 8.13 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.343 1.457 . . . . 0.0 111.402 -178.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 49.5 m170 -72.35 111.77 7.83 Favored 'General case' 0 C--O 1.233 0.232 0 O-C-N 120.283 -1.511 . . . . 0.0 107.789 171.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -78.65 147.78 33.45 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 175.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -142.64 143.65 32.45 Favored 'General case' 0 N--CA 1.435 -1.222 0 CA-C-N 113.114 -1.857 . . . . 0.0 107.248 -172.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 55.5 t -127.94 146.99 32.66 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 C-N-CA 128.519 2.728 . . . . 0.0 107.128 177.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 22.2 tp -87.96 138.76 31.17 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 124.926 1.291 . . . . 0.0 107.618 171.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -117.23 169.04 9.78 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 123.666 0.786 . . . . 0.0 111.39 176.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.428 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 20.6 mp0 -57.94 -24.67 58.95 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.359 1.464 . . . . 0.0 112.55 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -71.57 -0.51 10.81 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.508 1.123 . . . . 0.0 113.386 178.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 66.02 12.16 8.26 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 128.395 2.678 . . . . 0.0 113.883 -178.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.42 ' CD2' ' HD1' ' A' ' 68' ' ' HIS . 1.3 p-80 -99.56 179.95 4.39 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 124.36 1.064 . . . . 0.0 110.517 168.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 76.6 m95 -117.47 121.55 41.33 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.49 1.516 . . . . 0.0 107.02 175.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.42 ' HD1' ' CD2' ' A' ' 66' ' ' HIS . 0.2 OUTLIER -110.78 147.71 37.03 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 125.215 1.406 . . . . 0.0 111.804 179.208 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -67.16 145.72 73.83 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.903 2.402 . . . . 0.0 112.73 -170.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -138.04 43.78 2.2 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.48 1.112 . . . . 0.0 110.852 -172.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.52 164.6 0.13 Allowed Pre-proline 0 N--CA 1.47 0.575 0 C-N-CA 128.355 2.662 . . . . 0.0 113.779 175.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -69.73 168.64 20.93 Favored 'Trans proline' 0 N--CA 1.452 -0.961 0 C-N-CA 121.343 1.362 . . . . 0.0 111.367 167.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.3 tt -123.56 143.2 40.96 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 125.105 1.362 . . . . 0.0 108.51 -172.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -79.41 163.81 24.36 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.327 2.684 . . . . 0.0 112.178 -173.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.3 -7.88 17.09 Favored 'Trans proline' 0 CA--C 1.53 0.295 0 C-N-CA 123.119 2.546 . . . . 0.0 114.741 -178.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -106.71 -16.6 14.45 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.968 1.707 . . . . 0.0 112.398 173.439 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -67.03 -29.22 74.29 Favored Glycine 0 CA--C 1.531 1.07 0 CA-C-N 119.886 1.221 . . . . 0.0 112.281 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 30.7 tp -65.32 -50.58 65.12 Favored 'General case' 0 C--N 1.34 0.16 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -60.94 -30.57 70.3 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 125.57 1.548 . . . . 0.0 110.034 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -65.99 -47.93 72.89 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 119.281 0.946 . . . . 0.0 110.106 174.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 23.2 mt -64.61 -51.13 64.25 Favored 'General case' 0 CA--C 1.52 -0.177 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 -179.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 14.8 mm -58.77 -31.85 45.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 C-N-CA 123.633 0.773 . . . . 0.0 110.899 179.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -51.88 -38.91 57.95 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 119.914 1.233 . . . . 0.0 111.702 174.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.26 -57.65 10.38 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 118.811 0.732 . . . . 0.0 111.003 176.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.489 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 21.5 t60 -55.42 -46.72 76.66 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.323 1.049 . . . . 0.0 110.038 176.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 73.3 m -72.7 -24.22 60.97 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 120.589 -1.319 . . . . 0.0 112.917 -174.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -97.3 -8.94 28.55 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.512 1.125 . . . . 0.0 112.902 -177.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.5 t -89.71 -20.98 22.95 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 167.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 63.8 mt -115.63 -21.61 9.61 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -176.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 101.22 19.74 15.71 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 115.679 1.031 . . . . 0.0 115.679 172.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . 0.763 ' CD2' HD13 ' A' ' 112' ' ' LEU . 10.4 m-70 . . . . . 0 CA--C 1.533 0.326 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 -158.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.535 0.367 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.52 HD13 ' HB2' ' A' ' 105' ' ' ALA . 81.1 mt -141.27 142.74 33.88 Favored 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -168.245 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 1.4 m170 -75.64 -36.37 60.22 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 125.038 1.461 . . . . 0.0 110.357 -174.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.6 p -164.2 -173.93 3.33 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.963 1.305 . . . . 0.0 109.977 169.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 87.7 t -60.8 -41.41 88.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 C-N-CA 124.783 1.233 . . . . 0.0 111.059 176.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.9 -46.01 78.48 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 119.677 1.126 . . . . 0.0 110.032 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -66.01 -34.26 77.69 Favored 'General case' 0 C--O 1.227 -0.098 0 C-N-CA 123.138 0.575 . . . . 0.0 110.651 178.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.52 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -55.99 -53.04 61.77 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 123.244 0.618 . . . . 0.0 110.551 175.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 30.9 mm -60.86 -34.07 57.95 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 C-N-CA 123.275 0.63 . . . . 0.0 109.805 -176.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -81.15 -27.35 35.49 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.948 0.722 . . . . 0.0 112.948 178.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.431 ' CE2' HD11 ' A' ' 112' ' ' LEU . 29.0 t80 -67.33 -65.43 0.69 Allowed 'General case' 0 C--O 1.224 -0.255 0 C-N-CA 125.299 1.44 . . . . 0.0 107.976 172.813 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.525 ' HA ' HD12 ' A' ' 112' ' ' LEU . 8.9 mp -49.88 -46.18 51.35 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.359 1.464 . . . . 0.0 112.019 -176.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -69.52 -19.94 63.71 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 119.171 0.896 . . . . 0.0 113.166 -179.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -93.41 -19.34 21.39 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 123.814 0.846 . . . . 0.0 111.541 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.763 HD13 ' CD2' ' A' ' 91' ' ' HIS . 42.1 mt . . . . . 0 N--CA 1.452 -0.362 0 C-N-CA 124.404 1.082 . . . . 0.0 109.771 177.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 35.6 p . . . . . 0 C--O 1.242 0.688 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -77.77 76.21 4.41 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 122.569 2.179 . . . . 0.0 110.014 -177.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 75.22 144.63 0.11 Allowed Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 128.052 2.541 . . . . 0.0 112.048 -178.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -82.79 -25.96 2.69 Favored 'Trans proline' 0 CA--C 1.538 0.682 0 C-N-CA 122.743 2.296 . . . . 0.0 112.836 174.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -74.67 -18.06 60.59 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 121.226 -0.921 . . . . 0.0 111.891 176.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.7 tt -61.84 115.22 3.84 Favored 'General case' 0 C--N 1.34 0.18 0 N-CA-C 107.175 -1.417 . . . . 0.0 107.175 167.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 23.7 mm -98.3 116.05 40.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 N-CA-C 106.71 -1.589 . . . . 0.0 106.71 174.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -62.44 154.18 73.46 Favored Pre-proline 0 C--O 1.239 0.551 0 CA-C-O 119.558 -0.258 . . . . 0.0 110.347 175.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -66.92 166.59 61.24 Favored 'Cis proline' 0 N--CA 1.458 -0.602 0 N-CA-C 114.615 0.967 . . . . 0.0 114.615 -0.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -131.87 168.09 18.45 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 123.438 0.695 . . . . 0.0 110.732 176.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.515 HD22 HD12 ' A' ' 25' ' ' LEU . 12.3 mt -138.93 94.79 2.86 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 126.084 1.754 . . . . 0.0 108.209 -175.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.2 tp -74.59 142.12 44.67 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 171.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.43 97.18 3.0 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 174.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -56.69 154.59 8.73 Favored 'General case' 0 N--CA 1.444 -0.734 0 O-C-N 124.436 1.085 . . . . 0.0 112.189 -169.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -68.53 124.77 24.5 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 114.672 -1.149 . . . . 0.0 108.61 174.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 99.02 -46.84 1.42 Allowed Glycine 0 CA--C 1.518 0.28 0 C-N-CA 125.383 1.468 . . . . 0.0 111.518 178.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 76.0 m -76.36 175.16 9.38 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 122.312 1.054 . . . . 0.0 111.231 178.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -125.88 -22.99 4.05 Favored 'General case' 0 C--N 1.334 -0.095 0 C-N-CA 125.164 1.386 . . . . 0.0 110.499 -174.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -62.95 121.2 12.96 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 124.732 1.213 . . . . 0.0 108.988 -177.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.515 HD12 HD22 ' A' ' 16' ' ' LEU . 3.7 mm? -74.16 150.68 40.3 Favored 'General case' 0 N--CA 1.454 -0.254 0 O-C-N 121.019 -1.051 . . . . 0.0 109.916 172.332 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -111.25 86.87 6.8 Favored Pre-proline 0 CA--C 1.532 0.279 0 C-N-CA 124.689 1.196 . . . . 0.0 108.717 173.185 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -64.39 132.88 35.16 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 121.682 1.588 . . . . 0.0 108.973 174.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.8 mt -134.56 101.28 4.9 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 -178.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.16 -38.14 87.36 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 118.559 0.618 . . . . 0.0 111.058 -169.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.0 t -151.77 180.0 7.94 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 121.964 0.887 . . . . 0.0 110.418 172.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.64 -28.79 68.83 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 125.081 1.352 . . . . 0.0 112.613 -173.414 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -59.5 -39.8 85.01 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.015 0.825 . . . . 0.0 110.439 178.255 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -60.76 -48.58 81.18 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 124.611 1.165 . . . . 0.0 109.692 177.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 25.4 t-105 -58.69 -47.96 82.74 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 123.401 0.68 . . . . 0.0 111.322 175.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -64.61 -28.34 69.56 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 123.238 0.615 . . . . 0.0 110.982 -176.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.9 mtp-105 . . . . . 0 N--CA 1.466 0.372 0 C-N-CA 123.392 0.677 . . . . 0.0 112.034 168.481 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.0 mt . . . . . 0 C--O 1.231 0.13 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -111.56 148.49 33.13 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 124.498 1.119 . . . . 0.0 109.755 -170.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.403 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 13.0 m-85 -57.96 134.84 56.71 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 161.553 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 89.56 3.86 74.11 Favored Glycine 0 CA--C 1.531 1.057 0 CA-C-O 118.526 -1.152 . . . . 0.0 115.256 -177.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -70.25 -2.7 14.11 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 120.206 2.003 . . . . 0.0 115.675 -170.274 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.4 ttmm 45.96 117.28 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 130.94 3.696 . . . . 0.0 115.685 170.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 12.9 mt -103.35 159.79 15.26 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.324 167.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 91.1 t -137.0 154.91 31.95 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 C-N-CA 127.369 2.267 . . . . 0.0 105.09 163.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -123.69 -177.25 3.68 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.966 2.106 . . . . 0.0 111.496 -178.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.71 3.03 4.43 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.796 1.639 . . . . 0.0 113.247 178.246 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -123.55 16.71 9.63 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.696 1.998 . . . . 0.0 111.111 177.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 62.74 18.89 11.03 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.904 1.282 . . . . 0.0 111.889 175.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -70.87 108.47 4.52 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 119.959 -1.713 . . . . 0.0 108.672 170.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 56.5 m -69.49 151.06 46.5 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 119.451 -0.899 . . . . 0.0 108.576 164.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -137.37 161.07 37.28 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 125.241 1.416 . . . . 0.0 108.252 169.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 25.6 t -134.78 137.67 50.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 C-N-CA 130.288 3.435 . . . . 0.0 106.018 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 16.1 tp -85.84 133.21 33.98 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 170.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -110.1 174.31 5.92 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.534 1.134 . . . . 0.0 110.843 176.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.403 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 52.6 mt-10 -59.9 -18.61 46.11 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.989 1.716 . . . . 0.0 112.682 176.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -76.3 -7.62 55.32 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.167 0.987 . . . . 0.0 112.033 173.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 60.3 6.76 1.09 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 128.854 2.861 . . . . 0.0 114.815 -171.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 2.1 p-80 -76.11 161.78 28.56 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 119.641 1.11 . . . . 0.0 110.261 164.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 66.1 m95 -103.72 90.77 3.75 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 125.276 1.43 . . . . 0.0 107.943 176.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -78.62 163.41 61.28 Favored Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 124.53 1.132 . . . . 0.0 110.867 179.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.64 162.13 40.43 Favored 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.337 2.025 . . . . 0.0 110.595 -176.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -150.34 45.08 0.88 Allowed 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.348 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 69.03 165.11 0.13 Allowed Pre-proline 0 C--O 1.239 0.548 0 C-N-CA 127.375 2.27 . . . . 0.0 111.193 -174.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -72.82 -175.73 2.02 Favored 'Trans proline' 0 N--CA 1.447 -1.231 0 C-N-CA 121.409 1.406 . . . . 0.0 109.726 162.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.403 HD21 ' C ' ' A' ' 77' ' ' GLY . 8.4 tt -129.78 143.41 48.91 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 124.615 1.166 . . . . 0.0 107.935 -174.548 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -81.54 166.41 17.76 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.85 2.367 . . . . 0.0 110.645 -175.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -60.5 -26.36 82.63 Favored 'Trans proline' 0 CA--C 1.536 0.599 0 C-N-CA 121.153 1.236 . . . . 0.0 112.588 179.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -84.29 -18.0 37.79 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 124.892 1.277 . . . . 0.0 113.078 176.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.403 ' C ' HD21 ' A' ' 73' ' ' LEU . . . -72.45 -25.02 75.29 Favored Glycine 0 C--N 1.341 0.83 0 N-CA-C 111.225 -0.75 . . . . 0.0 111.225 -173.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 26.8 tp -65.02 -49.63 69.43 Favored 'General case' 0 C--N 1.339 0.131 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 177.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -56.58 -39.34 73.34 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.066 0.947 . . . . 0.0 109.304 173.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -65.9 -34.32 77.85 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.696 0.798 . . . . 0.0 112.146 178.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.7 mp -62.17 -64.0 1.07 Allowed 'General case' 0 C--N 1.34 0.173 0 O-C-N 121.076 -1.015 . . . . 0.0 109.044 168.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.467 HD12 HD11 ' A' ' 109' ' ' LEU . 32.9 mm -60.37 -26.96 38.68 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 123.167 0.587 . . . . 0.0 110.987 -170.38 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.74 -41.08 6.55 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 125.921 1.688 . . . . 0.0 111.714 169.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.45 -57.79 7.43 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 118.949 0.795 . . . . 0.0 110.765 -176.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.42 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 13.8 t60 -54.62 -48.01 72.73 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.659 1.184 . . . . 0.0 110.112 174.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 58.3 m -65.29 -37.01 85.83 Favored 'General case' 0 C--O 1.225 -0.199 0 O-C-N 120.849 -1.157 . . . . 0.0 111.231 -177.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -77.95 -16.91 57.78 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 119.154 0.888 . . . . 0.0 112.525 -178.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . 0.257 2.0 t -89.53 -30.27 18.34 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 119.51 1.05 . . . . 0.0 110.035 174.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 80.0 mt -96.07 -9.69 30.25 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 119.403 1.001 . . . . 0.0 112.966 178.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 73.16 28.82 65.57 Favored Glycine 0 CA--C 1.527 0.843 0 C-N-CA 125.453 1.501 . . . . 0.0 113.822 -178.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . 0.628 ' CD2' HD13 ' A' ' 112' ' ' LEU . 27.4 m-70 . . . . . 0 CA--C 1.539 0.528 0 CA-C-N 118.497 1.149 . . . . 0.0 111.871 -176.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 66.6 m80 . . . . . 0 CA--C 1.532 0.281 0 N-CA-C 111.189 0.07 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.639 HD13 ' HB2' ' A' ' 105' ' ' ALA . 97.8 mt -148.93 134.6 18.75 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.133 0.973 . . . . 0.0 108.883 -152.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 41.4 t-80 -69.39 -39.2 78.13 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 120.869 0.366 . . . . 0.0 111.253 178.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 5.2 t -164.29 -174.14 3.39 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.194 1.398 . . . . 0.0 108.895 176.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 88.9 t -61.05 -37.68 77.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 C-N-CA 125.622 1.569 . . . . 0.0 111.585 -176.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 11.4 ttm -57.56 -48.19 80.0 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 118.933 0.788 . . . . 0.0 110.286 177.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -54.34 -41.35 68.99 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 125.704 1.602 . . . . 0.0 110.254 -177.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.639 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -54.47 -47.9 72.41 Favored 'General case' 0 C--O 1.227 -0.113 0 C-N-CA 125.026 1.33 . . . . 0.0 111.766 177.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 38.5 mm -61.73 -43.72 97.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 -176.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -68.08 -34.49 76.5 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 118.671 -0.681 . . . . 0.0 111.398 178.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.492 ' CE2' HD11 ' A' ' 112' ' ' LEU . 33.0 t80 -60.47 -65.57 0.67 Allowed 'General case' 0 C--O 1.226 -0.133 0 C-N-CA 123.889 0.876 . . . . 0.0 109.433 174.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.467 HD11 HD12 ' A' ' 82' ' ' ILE . 8.0 mp -48.16 -49.91 30.77 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 125.246 1.418 . . . . 0.0 111.766 178.194 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 16.7 m-80 -65.54 -31.7 72.89 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 118.781 -0.628 . . . . 0.0 112.358 -178.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -75.86 -27.46 57.8 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 117.985 -1.007 . . . . 0.0 111.292 176.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.628 HD13 ' CD2' ' A' ' 91' ' ' HIS . 59.8 mt . . . . . 0 N--CA 1.457 -0.111 0 CA-C-N 119.406 1.003 . . . . 0.0 108.789 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 29.3 p . . . . . 0 N--CA 1.45 -0.452 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -73.49 94.63 0.85 Allowed 'Trans proline' 0 N--CA 1.444 -1.432 0 C-N-CA 121.837 1.691 . . . . 0.0 108.728 174.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 75.17 147.27 0.12 Allowed Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 128.35 2.66 . . . . 0.0 111.873 -174.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -79.39 -32.35 1.73 Allowed 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 123.264 2.643 . . . . 0.0 112.379 170.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -83.87 -6.6 59.46 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.851 1.26 . . . . 0.0 112.764 -176.04 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.44 132.29 49.6 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.838 1.255 . . . . 0.0 108.105 164.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.8 mm -115.33 115.83 50.61 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.131 0 C-N-CA 124.823 1.249 . . . . 0.0 107.966 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 71.2 m95 -60.6 151.33 71.44 Favored Pre-proline 0 C--O 1.235 0.296 0 C-N-CA 123.494 0.718 . . . . 0.0 111.725 177.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -72.32 174.15 49.54 Favored 'Cis proline' 0 CA--C 1.537 0.65 0 N-CA-C 115.266 1.218 . . . . 0.0 115.266 0.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -128.81 166.77 18.39 Favored 'General case' 0 C--N 1.344 0.339 0 C-N-CA 123.39 0.676 . . . . 0.0 112.817 -179.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 18.1 mt -139.49 99.63 3.78 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 127.795 2.438 . . . . 0.0 107.937 178.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 23.8 tp -70.44 152.95 43.49 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 117.883 -1.056 . . . . 0.0 108.444 169.41 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.424 ' HG2' ' HG ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -144.87 85.95 1.77 Allowed 'General case' 0 C--O 1.234 0.267 0 CA-C-N 120.238 1.381 . . . . 0.0 111.588 170.805 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -44.45 127.28 5.82 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 125.728 1.611 . . . . 0.0 110.517 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.4 tp60 -68.49 90.77 0.39 Allowed 'General case' 0 N--CA 1.432 -1.366 0 C-N-CA 126.036 1.735 . . . . 0.0 111.142 -170.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 115.06 -17.55 17.12 Favored Glycine 0 CA--C 1.524 0.627 0 CA-C-O 118.267 -1.296 . . . . 0.0 112.173 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.422 ' C ' ' H ' ' A' ' 24' ' ' GLU . 3.8 t -71.38 -33.35 69.45 Favored 'General case' 0 C--O 1.22 -0.454 0 CA-C-N 118.881 1.341 . . . . 0.0 109.957 173.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.605 ' HB3' ' HB1' ' A' ' 84' ' ' ALA . 7.9 m-80 68.7 -20.83 0.15 Allowed 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.908 1.683 . . . . 0.0 112.552 -172.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.422 ' H ' ' C ' ' A' ' 22' ' ' CYS . 23.3 tt0 -64.86 138.26 58.27 Favored 'General case' 0 N--CA 1.441 -0.918 0 C-N-CA 125.308 1.443 . . . . 0.0 108.352 172.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.757 HD13 HD13 ' A' ' 82' ' ' ILE . 1.3 mt -96.98 150.6 20.58 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 124.164 0.986 . . . . 0.0 108.519 169.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -113.73 87.83 12.85 Favored Pre-proline 0 C--N 1.327 -0.403 0 C-N-CA 124.768 1.227 . . . . 0.0 110.226 175.104 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -64.23 137.43 56.33 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 123.083 2.522 . . . . 0.0 109.994 176.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.7 mt -141.47 117.12 10.32 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 106.783 -1.562 . . . . 0.0 106.783 -177.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -69.0 -53.59 19.74 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.235 0.541 . . . . 0.0 112.03 -173.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 64.3 p -138.85 165.11 27.89 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.983 0.913 . . . . 0.0 108.612 -175.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -50.59 -30.85 14.25 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 123.384 0.674 . . . . 0.0 112.652 -177.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.9 -42.54 76.15 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.257 1.023 . . . . 0.0 111.595 174.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.44 -47.32 79.53 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 121.216 -0.927 . . . . 0.0 110.484 179.038 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 41.0 t-105 -58.06 -47.04 84.35 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 176.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 -55.09 -58.41 7.76 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.474 0.709 . . . . 0.0 109.444 178.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.468 0.439 0 C-N-CA 125.336 1.455 . . . . 0.0 113.587 -178.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 85.1 mt . . . . . 0 C--O 1.235 0.299 0 CA-C-O 121.308 0.575 . . . . 0.0 109.637 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -149.85 162.33 40.51 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.616 1.166 . . . . 0.0 109.051 -173.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -71.39 105.01 3.37 Favored 'General case' 0 C--O 1.237 0.443 0 O-C-N 121.612 -0.68 . . . . 0.0 109.217 -163.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 122.47 5.31 8.61 Favored Glycine 0 CA--C 1.526 0.748 0 CA-C-O 117.433 -1.759 . . . . 0.0 114.787 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.95 -15.58 1.45 Allowed 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 117.255 2.317 . . . . 0.0 117.255 -175.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.5 ttmt 44.63 125.67 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.221 1 C-N-CA 132.171 4.188 . . . . 0.0 115.295 -177.005 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.7 mt -109.99 139.42 45.11 Favored 'General case' 0 CA--C 1.512 -0.51 0 O-C-N 120.942 -1.099 . . . . 0.0 108.089 166.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 55.2 t -113.01 151.29 14.92 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 N-CA-C 105.098 -2.186 . . . . 0.0 105.098 162.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -131.22 172.19 12.42 Favored 'General case' 0 N--CA 1.437 -1.118 0 C-N-CA 130.294 3.438 . . . . 0.0 108.617 -177.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.7 t -56.71 -20.69 23.11 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.36 1.464 . . . . 0.0 113.048 177.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -98.35 -0.09 44.43 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.096 1.758 . . . . 0.0 112.619 -169.641 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 59.63 15.3 4.55 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.989 1.716 . . . . 0.0 112.54 -171.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 48.1 m170 -70.18 106.4 3.28 Favored 'General case' 0 CA--C 1.529 0.15 0 O-C-N 120.076 -1.64 . . . . 0.0 109.638 164.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 2.9 t -71.86 151.57 43.3 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 174.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -139.1 153.77 48.06 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 124.55 1.14 . . . . 0.0 108.757 176.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 27.8 t -141.91 135.41 29.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 C-N-CA 127.526 2.33 . . . . 0.0 107.336 -176.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 29.5 tp -80.7 133.44 35.69 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 126.051 1.74 . . . . 0.0 107.719 176.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -125.83 170.35 11.71 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.14 0.976 . . . . 0.0 109.441 178.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -66.57 -29.3 69.34 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.12 0.968 . . . . 0.0 112.001 -167.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -66.73 8.8 0.22 Allowed 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.795 1.238 . . . . 0.0 112.954 171.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 63.48 28.25 15.31 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 126.434 1.894 . . . . 0.0 111.674 168.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.4 p-80 -114.75 166.52 11.66 Favored 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 124.948 1.299 . . . . 0.0 110.191 170.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 65.3 m95 -103.71 98.09 8.01 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 126.638 1.975 . . . . 0.0 106.785 174.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 63.3 t-80 -71.08 143.52 88.79 Favored Pre-proline 0 CA--C 1.539 0.55 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 178.17 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -72.08 113.39 3.67 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 123.806 3.004 . . . . 0.0 109.669 172.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -91.89 34.54 1.0 Allowed 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.95 1.7 . . . . 0.0 111.99 -173.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.534 ' HB1' ' HD2' ' A' ' 72' ' ' PRO . . . 64.89 166.27 0.12 Allowed Pre-proline 0 CA--C 1.547 0.849 0 C-N-CA 126.684 1.994 . . . . 0.0 111.759 -175.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.534 ' HD2' ' HB1' ' A' ' 71' ' ' ALA . 62.0 Cg_endo -67.03 -177.8 1.13 Allowed 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 121.931 1.754 . . . . 0.0 112.626 178.425 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.2 tt -132.61 143.88 50.62 Favored Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 126.053 1.741 . . . . 0.0 108.745 -175.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -80.83 164.4 20.41 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 123.005 2.47 . . . . 0.0 111.968 -176.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -61.44 -10.87 17.41 Favored 'Trans proline' 0 CA--C 1.528 0.224 0 C-N-CA 123.013 2.475 . . . . 0.0 115.441 178.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -106.34 -15.59 14.79 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.043 1.737 . . . . 0.0 113.505 175.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.59 -37.99 95.59 Favored Glycine 0 CA--C 1.529 0.93 0 CA-C-N 119.051 0.841 . . . . 0.0 111.301 -177.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.3 tp -52.74 -47.74 67.18 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 125.291 1.436 . . . . 0.0 108.384 177.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -75.64 -17.34 60.02 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 127.625 2.37 . . . . 0.0 110.527 -170.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -84.31 -42.39 15.86 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.043 1.337 . . . . 0.0 110.502 170.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.5 mp -58.99 -52.74 64.46 Favored 'General case' 0 N--CA 1.46 0.073 0 C-N-CA 123.196 0.598 . . . . 0.0 109.895 176.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.757 HD13 HD13 ' A' ' 25' ' ' LEU . 4.1 mm -62.1 -33.51 58.84 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.148 0 C-N-CA 123.675 0.79 . . . . 0.0 110.653 178.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.86 -42.36 58.8 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 121.455 -0.778 . . . . 0.0 110.923 171.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.605 ' HB1' ' HB3' ' A' ' 23' ' ' ASN . . . -65.75 -42.64 90.68 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 118.997 -0.525 . . . . 0.0 112.3 -177.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.571 ' CB ' HD12 ' A' ' 25' ' ' LEU . 7.8 t60 -60.14 -53.44 57.77 Favored 'General case' 0 C--O 1.222 -0.346 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 172.547 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 94.8 m -57.03 -42.24 80.07 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 121.361 -0.837 . . . . 0.0 110.201 -174.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.42 -22.26 66.78 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-O 116.832 -1.556 . . . . 0.0 114.239 -178.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.444 HG23 ' CD2' ' A' ' 89' ' ' LEU 0.377 11.8 t -93.57 -13.39 27.77 Favored 'General case' 0 C--N 1.345 0.403 0 CA-C-N 121.3 1.863 . . . . 0.0 110.925 -177.06 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.444 ' CD2' HG23 ' A' ' 88' ' ' THR . 1.0 OUTLIER -107.85 -14.61 14.74 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 126.322 1.849 . . . . 0.0 111.625 -179.248 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 77.87 15.21 81.49 Favored Glycine 0 CA--C 1.53 0.988 0 CA-C-O 118.416 -1.214 . . . . 0.0 113.27 -172.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 69.2 m-70 . . . . . 0 C--O 1.235 0.315 0 CA-C-N 119.163 1.482 . . . . 0.0 109.57 -178.003 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 4.6 t-160 . . . . . 0 CA--C 1.546 0.826 0 CA-C-O 117.688 -1.148 . . . . 0.0 109.749 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 93.3 mt -141.63 153.56 44.83 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 121.851 2.114 . . . . 0.0 110.639 174.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 23.9 t-80 -75.37 -39.25 59.45 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.716 175.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -175.05 178.28 1.79 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 122.948 0.499 . . . . 0.0 111.464 -167.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 58.4 t -64.45 -39.47 85.68 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 123.653 0.781 . . . . 0.0 109.892 -176.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 3.5 tpt -56.92 -32.1 65.6 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.795 -0.566 . . . . 0.0 111.796 177.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -72.2 -48.74 40.8 Favored 'General case' 0 C--O 1.226 -0.176 0 C-N-CA 124.429 1.091 . . . . 0.0 108.221 176.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.06 -50.08 67.54 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 125.224 1.41 . . . . 0.0 112.542 -178.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 37.6 mm -57.17 -45.81 84.58 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -178.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -74.03 -24.73 59.59 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.279 1.032 . . . . 0.0 112.733 -175.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -67.26 -70.46 0.25 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.993 0.917 . . . . 0.0 109.088 168.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 9.4 mp -51.39 -51.19 56.81 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 127.02 2.128 . . . . 0.0 113.298 -177.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -64.23 -12.6 42.39 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 118.186 -0.911 . . . . 0.0 112.28 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -100.85 -7.25 23.74 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 120.105 1.32 . . . . 0.0 112.303 175.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 95.8 mt . . . . . 0 C--O 1.235 0.294 0 C-N-CA 124.79 1.236 . . . . 0.0 110.194 173.619 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.235 0.307 0 CA-C-O 118.364 -0.827 . . . . 0.0 109.159 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -69.16 -55.33 0.2 Allowed 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 121.009 1.139 . . . . 0.0 110.555 -167.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . 0.409 ' CD2' ' HD2' ' A' ' 9' ' ' PRO . 5.4 t-80 -144.5 148.36 40.0 Favored Pre-proline 0 N--CA 1.451 -0.407 0 C-N-CA 126.614 1.965 . . . . 0.0 106.409 172.726 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.409 ' HD2' ' CD2' ' A' ' 8' ' ' HIS . 51.9 Cg_endo -72.96 -28.98 12.53 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 CA-C-N 120.919 1.364 . . . . 0.0 112.658 179.409 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -80.63 -10.02 59.76 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 118.726 -0.654 . . . . 0.0 112.06 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.5 tt -58.76 132.65 54.54 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 119.084 0.856 . . . . 0.0 109.851 168.411 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.449 ' CG1' HD21 ' A' ' 55' ' ' ASN . 45.6 mm -113.77 113.01 42.67 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 175.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 76.6 m95 -57.8 150.11 49.9 Favored Pre-proline 0 C--O 1.241 0.637 0 C-N-CA 123.255 0.622 . . . . 0.0 111.346 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -71.72 173.22 52.2 Favored 'Cis proline' 0 CA--C 1.54 0.785 0 N-CA-C 114.768 1.026 . . . . 0.0 114.768 0.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -131.17 167.47 19.1 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 124.29 1.036 . . . . 0.0 111.818 176.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.402 ' HA ' HD23 ' A' ' 16' ' ' LEU . 27.1 mt -139.54 105.09 5.09 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 126.851 2.061 . . . . 0.0 110.031 -175.269 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.476 HD23 ' CZ3' ' A' ' 34' ' ' TRP . 0.2 OUTLIER -81.56 165.01 21.52 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 123.602 0.761 . . . . 0.0 109.592 168.534 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.451 ' H ' HD13 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -156.64 88.04 1.04 Allowed 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 119.445 -0.312 . . . . 0.0 110.445 163.248 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 22.5 mt-30 -51.6 135.6 28.12 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -166.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -68.26 116.73 9.19 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 -176.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 105.3 -2.79 40.19 Favored Glycine 0 CA--C 1.525 0.704 0 CA-C-O 117.398 -1.779 . . . . 0.0 113.615 -173.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.83 172.75 7.94 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 119.956 1.878 . . . . 0.0 109.929 165.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.417 ' HB3' ' HB1' ' A' ' 84' ' ' ALA . 8.3 m-80 -110.95 -17.62 13.26 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 125.501 1.52 . . . . 0.0 108.881 177.068 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -76.24 127.98 34.0 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 -177.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.42 HD23 ' HB2' ' A' ' 18' ' ' LYS . 1.3 mt -82.53 159.51 22.81 Favored 'General case' 0 C--O 1.231 0.1 0 C-N-CA 123.48 0.712 . . . . 0.0 109.539 170.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -122.6 88.95 49.79 Favored Pre-proline 0 C--N 1.328 -0.33 0 C-N-CA 125.665 1.586 . . . . 0.0 110.71 -173.475 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -62.09 126.3 18.39 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 123.777 2.985 . . . . 0.0 109.961 179.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -115.28 100.37 8.08 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 107.154 -1.425 . . . . 0.0 107.154 169.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 67.5 mtt-85 -52.64 -53.16 50.81 Favored 'General case' 0 N--CA 1.463 0.196 0 C-N-CA 124.584 1.154 . . . . 0.0 110.59 175.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.0 t -144.23 -177.75 5.62 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 122.313 1.054 . . . . 0.0 109.828 178.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -50.92 -39.1 53.78 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 126.571 1.948 . . . . 0.0 110.841 178.142 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -43.03 98.23 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.393 0.677 . . . . 0.0 111.222 178.185 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -68.2 -26.82 65.92 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 124.33 1.052 . . . . 0.0 110.773 -177.467 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.476 ' CZ3' HD23 ' A' ' 17' ' ' LEU . 60.8 t-105 -79.25 -41.18 28.79 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 123.663 0.785 . . . . 0.0 111.81 170.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -58.04 -45.66 86.63 Favored 'General case' 0 N--CA 1.462 0.132 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 178.167 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.466 0.344 0 C-N-CA 125.209 1.404 . . . . 0.0 112.363 173.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 49.0 mt . . . . . 0 CA--C 1.512 -0.491 0 N-CA-C 105.157 -2.164 . . . . 0.0 105.157 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -121.1 164.44 16.82 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 123.584 0.754 . . . . 0.0 109.81 -178.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.428 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 13.3 m-85 -60.34 138.64 57.93 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 176.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 84.2 9.12 82.67 Favored Glycine 0 CA--C 1.524 0.614 0 CA-C-O 119.106 -0.83 . . . . 0.0 113.496 174.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.404 ' HB3' HD11 ' A' ' 17' ' ' LEU . 2.2 m-20 -65.46 -25.88 67.7 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 119.41 1.605 . . . . 0.0 112.485 -171.637 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 19.9 ttmt 75.12 145.5 0.08 Allowed 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 129.523 3.129 . . . . 0.0 112.421 175.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 9.4 tp -135.57 157.86 45.82 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 107.521 -1.288 . . . . 0.0 107.521 171.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 24.2 t -134.45 141.89 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.74 0 C-N-CA 127.456 2.302 . . . . 0.0 106.27 167.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -104.11 176.65 5.08 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.897 1.279 . . . . 0.0 112.067 167.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -69.54 -5.41 24.08 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 -179.581 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.449 HD21 ' CG1' ' A' ' 12' ' ' ILE . 70.3 m-80 -89.87 -1.27 57.95 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 119.412 1.005 . . . . 0.0 111.252 170.016 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 70.13 18.97 6.88 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 127.08 2.152 . . . . 0.0 110.959 -171.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 23.4 m170 -66.88 117.24 8.71 Favored 'General case' 0 C--N 1.34 0.164 0 O-C-N 120.801 -1.187 . . . . 0.0 108.891 169.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 72.6 m -83.11 156.32 23.35 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 118.997 0.817 . . . . 0.0 110.11 169.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -144.71 158.45 43.78 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 125.968 1.707 . . . . 0.0 109.313 177.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 24.4 t -115.86 162.73 13.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 C-N-CA 127.885 2.474 . . . . 0.0 106.907 169.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.52 HD12 ' O ' ' A' ' 66' ' ' HIS . 29.2 tp -111.82 133.45 54.02 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 166.328 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 62.1 mp0 -113.58 -172.8 2.14 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.742 2.017 . . . . 0.0 109.807 -171.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.428 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 2.5 mp0 -77.06 -18.31 58.15 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 120.734 -1.229 . . . . 0.0 113.3 178.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -75.25 -7.98 55.36 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 127.502 2.321 . . . . 0.0 113.444 -168.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 64.34 17.1 10.57 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 129.158 2.983 . . . . 0.0 114.376 -161.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.52 ' O ' HD12 ' A' ' 61' ' ' LEU . 1.1 p-80 -93.94 162.4 13.91 Favored 'General case' 0 C--N 1.34 0.195 0 C-N-CA 125.881 1.672 . . . . 0.0 114.336 164.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.415 ' NE1' HD13 ' A' ' 61' ' ' LEU . 62.0 m95 -106.58 106.41 16.92 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 106.644 -1.613 . . . . 0.0 106.644 164.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.406 ' CG ' ' HD2' ' A' ' 69' ' ' PRO . 0.1 OUTLIER -87.13 156.37 54.62 Favored Pre-proline 0 CA--C 1.545 0.773 0 C-N-CA 123.484 0.713 . . . . 0.0 109.104 175.083 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.406 ' HD2' ' CG ' ' A' ' 68' ' ' HIS . 66.9 Cg_endo -79.78 156.21 24.03 Favored 'Trans proline' 0 N--CA 1.455 -0.759 0 C-N-CA 122.303 2.002 . . . . 0.0 111.989 -172.151 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -132.25 31.91 4.04 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.056 1.342 . . . . 0.0 110.991 -177.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 71.72 165.42 0.13 Allowed Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 128.115 2.566 . . . . 0.0 111.802 179.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -71.43 -179.18 3.43 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 121.677 1.585 . . . . 0.0 109.927 169.226 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 12.8 tp -133.68 150.89 76.02 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-O 118.56 -0.733 . . . . 0.0 111.699 -174.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -61.97 159.47 33.81 Favored 'Trans proline' 0 CA--C 1.536 0.589 0 C-N-CA 122.178 1.919 . . . . 0.0 111.173 166.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -67.88 -38.06 14.17 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 122.329 2.019 . . . . 0.0 111.245 -178.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -72.86 -11.02 60.43 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 124.162 0.985 . . . . 0.0 110.569 175.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -68.78 -28.5 73.05 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-O 118.934 -0.926 . . . . 0.0 111.416 171.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 46.5 tp -62.88 -54.15 43.18 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 118.523 1.161 . . . . 0.0 108.728 170.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -50.24 -43.92 53.17 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.588 1.155 . . . . 0.0 111.661 177.36 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -60.78 -36.82 79.94 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 126.099 1.76 . . . . 0.0 112.724 177.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.423 HD13 ' HA ' ' A' ' 81' ' ' LEU . 1.2 mm? -72.22 -54.4 9.72 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 119.181 0.9 . . . . 0.0 109.84 172.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.406 ' HA ' ' CD1' ' A' ' 25' ' ' LEU . 4.4 mm -50.01 -37.82 13.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 126.372 1.869 . . . . 0.0 110.553 -177.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.01 -40.62 6.66 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 125.687 1.595 . . . . 0.0 112.661 176.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.417 ' HB1' ' HB3' ' A' ' 23' ' ' ASN . . . -60.34 -58.36 8.86 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 119.573 1.078 . . . . 0.0 111.581 178.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -58.82 -45.48 89.88 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 124.166 0.986 . . . . 0.0 109.383 -179.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 96.0 m -73.32 -17.18 61.33 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 120.641 -1.287 . . . . 0.0 112.774 -176.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -84.47 -20.62 31.42 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 119.396 0.998 . . . . 0.0 112.17 173.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.4 t -100.87 -17.35 16.89 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.37 0.532 . . . . 0.0 111.009 -178.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 52.2 mt -102.18 2.83 37.74 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.973 1.309 . . . . 0.0 111.166 165.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 66.59 15.4 64.0 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 125.187 1.375 . . . . 0.0 115.692 171.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 37.4 m-70 . . . . . 0 C--O 1.235 0.291 0 CA-C-N 119.5 1.65 . . . . 0.0 112.648 -174.14 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.226 -0.149 0 CA-C-O 121.007 0.432 . . . . 0.0 111.176 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 91.4 mt -155.08 121.87 5.42 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 126.259 1.824 . . . . 0.0 107.351 -155.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 32.1 t-80 -67.88 -37.1 81.36 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 117.889 0.313 . . . . 0.0 111.371 171.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 4.7 t -158.92 176.12 12.71 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.781 0.832 . . . . 0.0 111.477 -171.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 79.0 t -55.77 -36.9 44.85 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 C-N-CA 124.19 0.996 . . . . 0.0 108.988 167.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 26.0 tpp -60.01 -39.6 86.37 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.611 0.764 . . . . 0.0 112.311 178.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -61.28 -52.77 63.35 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 176.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.77 -41.7 70.82 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 125.005 1.322 . . . . 0.0 112.338 -171.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 22.4 mm -56.73 -46.89 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.266 0 CA-C-N 120.03 1.286 . . . . 0.0 111.127 -177.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -79.83 -36.89 36.18 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 118.164 0.438 . . . . 0.0 110.194 -178.27 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -59.77 -51.6 69.06 Favored 'General case' 0 C--N 1.337 0.056 0 C-N-CA 125.09 1.356 . . . . 0.0 110.978 -178.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 95.8 mt -68.06 -31.27 70.79 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 125.083 1.353 . . . . 0.0 110.902 -177.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -65.99 -40.15 90.93 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-O 118.894 -0.574 . . . . 0.0 110.8 175.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -75.07 0.68 15.25 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.583 1.153 . . . . 0.0 113.071 -179.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 45.4 mt . . . . . 0 N--CA 1.457 -0.109 0 CA-C-N 118.95 0.795 . . . . 0.0 110.488 166.766 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.7 p . . . . . 0 CA--C 1.537 0.479 0 N-CA-C 110.546 -0.168 . . . . 0.0 110.546 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -67.88 -55.0 0.29 Allowed 'Trans proline' 0 N--CA 1.459 -0.5 0 C-N-CA 122.467 2.111 . . . . 0.0 111.267 -169.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -135.75 144.29 48.23 Favored Pre-proline 0 C--O 1.238 0.482 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 176.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -77.4 -17.75 14.43 Favored 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 122.394 2.063 . . . . 0.0 111.965 -176.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -81.43 -26.43 35.36 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 117.636 -1.174 . . . . 0.0 111.964 173.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 tt -56.68 133.34 53.85 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.295 0.952 . . . . 0.0 109.823 -171.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.434 ' CG1' HD21 ' A' ' 55' ' ' ASN . 46.7 mm -112.71 116.37 52.4 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.123 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 -175.051 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 76.5 m95 -60.52 154.35 55.71 Favored Pre-proline 0 N--CA 1.45 -0.444 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.64 176.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -72.15 162.94 88.84 Favored 'Cis proline' 0 N--CA 1.458 -0.597 0 C-N-CA 124.853 -0.895 . . . . 0.0 112.684 -3.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -131.96 166.53 21.48 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 121.773 0.797 . . . . 0.0 110.966 179.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 38.6 mt -138.26 106.5 5.77 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 124.917 1.287 . . . . 0.0 108.813 -170.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.2 tp -84.67 148.79 26.23 Favored 'General case' 0 C--O 1.236 0.395 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 171.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -142.54 96.67 2.98 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 119.612 1.097 . . . . 0.0 108.592 167.135 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -55.15 151.57 9.14 Favored 'General case' 0 C--O 1.24 0.575 0 O-C-N 124.628 1.205 . . . . 0.0 112.425 -164.495 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -71.02 88.56 0.77 Allowed 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.512 0.672 . . . . 0.0 110.967 -177.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 137.15 -34.3 2.21 Favored Glycine 0 CA--C 1.524 0.633 0 C-N-CA 126.251 1.881 . . . . 0.0 110.618 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 85.3 m -76.86 177.07 7.96 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 122.89 1.329 . . . . 0.0 111.257 -178.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -128.82 -35.25 1.89 Allowed 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 126.712 2.005 . . . . 0.0 109.216 -175.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -59.69 131.71 51.76 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.231 1.412 . . . . 0.0 107.856 169.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.424 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -84.17 150.73 25.31 Favored 'General case' 0 CA--C 1.515 -0.393 0 C-N-CA 124.351 1.061 . . . . 0.0 108.678 164.232 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.424 HD22 ' HA ' ' A' ' 26' ' ' LEU . 0.2 OUTLIER -103.68 88.64 1.89 Allowed Pre-proline 0 C--N 1.327 -0.403 0 C-N-CA 128.294 2.637 . . . . 0.0 107.549 176.277 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -56.89 127.13 24.59 Favored 'Trans proline' 0 N--CA 1.45 -1.037 0 N-CA-C 108.988 -1.197 . . . . 0.0 108.988 169.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -118.22 103.54 9.94 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 106.089 -1.819 . . . . 0.0 106.089 166.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 67.8 mtt85 -56.74 -42.51 79.41 Favored 'General case' 0 CA--C 1.519 -0.213 0 O-C-N 122.279 -0.263 . . . . 0.0 110.562 174.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.429 HG23 ' H ' ' A' ' 32' ' ' ASP . 5.0 t -157.49 -177.47 6.62 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 118.344 0.52 . . . . 0.0 110.782 -177.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -51.95 -42.37 62.8 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 125.411 1.485 . . . . 0.0 110.695 174.256 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.429 ' H ' HG23 ' A' ' 30' ' ' THR . 22.0 t70 -54.44 -50.77 66.87 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-N 118.713 0.688 . . . . 0.0 110.639 175.627 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -57.2 -45.6 83.64 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.217 1.407 . . . . 0.0 110.368 178.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 39.6 t-105 -58.3 -40.93 83.31 Favored 'General case' 0 C--N 1.34 0.18 0 C-N-CA 123.8 0.84 . . . . 0.0 111.274 176.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.91 -45.25 90.76 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 178.472 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 8.4 mtt180 . . . . . 0 N--CA 1.456 -0.149 0 C-N-CA 124.056 0.943 . . . . 0.0 111.531 -168.978 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 72.3 mt . . . . . 0 N--CA 1.452 -0.338 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -158.91 131.14 6.7 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 104.652 -2.351 . . . . 0.0 104.652 -167.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.717 ' HA ' HD13 ' A' ' 61' ' ' LEU . 52.8 m-85 -60.07 144.08 50.46 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 -176.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.11 8.28 66.94 Favored Glycine 0 N--CA 1.443 -0.848 0 CA-C-O 118.292 -1.282 . . . . 0.0 114.812 -179.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.47 -9.76 14.31 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.542 1.937 . . . . 0.0 115.207 -174.029 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 15.8 ttmt 51.09 135.55 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.08 1 C-N-CA 132.025 4.13 . . . . 0.0 115.66 174.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 11.5 mt -129.38 157.57 41.58 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 121.088 -1.007 . . . . 0.0 109.568 174.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 37.4 t -135.26 141.35 42.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 127.476 2.31 . . . . 0.0 106.026 173.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -118.1 179.63 4.04 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.803 1.641 . . . . 0.0 111.781 172.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 98.5 p -61.12 -27.3 68.28 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.876 1.271 . . . . 0.0 113.653 -175.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.434 HD21 ' CG1' ' A' ' 12' ' ' ILE . 14.1 m-80 -82.73 1.22 39.84 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 125.64 1.576 . . . . 0.0 110.745 178.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 61.3 23.73 13.92 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.542 1.537 . . . . 0.0 110.405 -170.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 27.8 m170 -61.08 124.04 19.39 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 120.699 1.59 . . . . 0.0 107.515 164.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.498 ' HB3' ' HB3' ' A' ' 70' ' ' ALA . 0.7 OUTLIER -88.5 145.85 25.51 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 107.138 -1.431 . . . . 0.0 107.138 166.785 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -135.99 155.69 49.87 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.192 0.997 . . . . 0.0 109.028 174.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 40.0 t -141.62 131.63 25.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 C-N-CA 128.046 2.538 . . . . 0.0 107.074 -177.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.717 HD13 ' HA ' ' A' ' 47' ' ' TYR . 0.2 OUTLIER -74.55 123.33 24.6 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 107.159 -1.422 . . . . 0.0 107.159 169.436 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -110.54 167.31 10.31 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.225 0.921 . . . . 0.0 109.438 173.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -59.54 -4.16 0.58 Allowed 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.848 1.259 . . . . 0.0 113.643 178.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -77.87 -2.73 38.11 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 120.606 -1.309 . . . . 0.0 111.755 167.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 70.68 -3.0 2.06 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 126.613 1.965 . . . . 0.0 112.286 -178.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -89.1 166.17 14.03 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 123.604 0.762 . . . . 0.0 110.737 175.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 68.5 m95 -107.35 97.41 7.17 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 125.616 1.567 . . . . 0.0 107.012 173.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 54.9 t-80 -79.81 145.09 61.28 Favored Pre-proline 0 CA--C 1.543 0.705 0 CA-C-O 118.122 -0.942 . . . . 0.0 110.222 -175.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -68.47 109.0 1.94 Allowed 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 124.166 3.244 . . . . 0.0 112.5 172.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.498 ' HB3' ' HB3' ' A' ' 58' ' ' CYS . . . -80.0 21.05 0.59 Allowed 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.287 1.435 . . . . 0.0 111.858 170.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 67.17 165.85 0.12 Allowed Pre-proline 0 C--O 1.237 0.434 0 C-N-CA 127.3 2.24 . . . . 0.0 111.817 -176.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -65.05 163.9 26.99 Favored 'Trans proline' 0 N--CA 1.447 -1.23 0 C-N-CA 120.81 1.007 . . . . 0.0 112.39 174.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 15.8 tp -118.95 146.75 40.95 Favored Pre-proline 0 CA--C 1.535 0.39 0 C-N-CA 126.279 1.832 . . . . 0.0 110.102 -173.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.49 164.35 31.23 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 122.278 1.985 . . . . 0.0 111.523 173.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -59.02 -33.54 98.77 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.843 2.362 . . . . 0.0 112.353 178.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -77.58 -24.71 49.7 Favored 'General case' 0 N--CA 1.454 -0.239 0 O-C-N 121.697 -0.627 . . . . 0.0 111.239 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -64.43 -29.13 74.25 Favored Glycine 0 CA--C 1.532 1.127 0 CA-C-N 118.4 0.545 . . . . 0.0 112.396 -174.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 37.5 tp -55.73 -53.0 61.98 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 124.871 1.268 . . . . 0.0 109.638 169.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -64.25 -25.78 68.21 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.255 0.622 . . . . 0.0 111.3 -173.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -72.26 -20.41 61.53 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.761 0.824 . . . . 0.0 112.521 177.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 67.1 mt -83.17 -50.22 8.67 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 118.924 0.784 . . . . 0.0 109.026 168.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.8 mm -50.87 -40.28 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 126.094 1.758 . . . . 0.0 111.655 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.82 -41.81 7.33 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 125.104 1.362 . . . . 0.0 110.751 176.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -73.78 -44.77 55.02 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -178.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.424 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 5.6 t60 -62.87 -45.06 94.32 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 119.682 1.128 . . . . 0.0 108.843 177.526 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 91.9 m -62.69 -41.05 98.92 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.484 177.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.69 -33.31 73.74 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -178.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 9.2 t -74.4 -38.89 62.98 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.971 0.805 . . . . 0.0 109.042 -177.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 78.4 mt -87.41 -52.11 5.55 Favored 'General case' 0 N--CA 1.462 0.166 0 O-C-N 121.659 -0.651 . . . . 0.0 109.772 -173.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 115.98 58.06 0.33 Allowed Glycine 0 CA--C 1.523 0.535 0 C-N-CA 125.971 1.748 . . . . 0.0 108.918 -179.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . 0.753 ' CD2' HD13 ' A' ' 112' ' ' LEU . 13.3 m-70 . . . . . 0 C--O 1.236 0.372 0 C-N-CA 123.777 0.831 . . . . 0.0 110.895 -175.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.455 -0.207 0 CA-C-O 119.194 -0.432 . . . . 0.0 110.463 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.418 HD13 ' HB2' ' A' ' 105' ' ' ALA . 89.7 mt -154.3 163.38 40.23 Favored 'General case' 0 CA--C 1.514 -0.433 0 C-N-CA 127.119 2.168 . . . . 0.0 109.88 -170.427 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 16.0 t-160 -86.56 -37.39 18.2 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 123.692 0.797 . . . . 0.0 112.644 169.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 4.5 t -172.41 -178.92 2.11 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 118.582 0.628 . . . . 0.0 112.684 -165.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 45.2 t -68.05 -39.82 82.11 Favored 'Isoleucine or valine' 0 C--N 1.345 0.371 0 C-N-CA 124.048 0.939 . . . . 0.0 111.194 -179.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -59.89 -44.89 93.98 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 177.599 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.55 -49.71 67.09 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 127.388 2.275 . . . . 0.0 109.968 174.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.418 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -59.21 -56.29 24.0 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 124.924 1.29 . . . . 0.0 111.28 179.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 3.4 mm -60.17 -41.07 85.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -174.106 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -59.98 -50.05 75.27 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 124.032 0.933 . . . . 0.0 110.25 176.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.704 ' CE2' HD11 ' A' ' 112' ' ' LEU . 48.4 t80 -54.5 -67.46 0.26 Allowed 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 126.666 1.986 . . . . 0.0 110.022 178.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.54 ' HA ' HD12 ' A' ' 112' ' ' LEU . 6.9 mp -47.48 -49.95 24.44 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 125.266 1.426 . . . . 0.0 111.681 179.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 63.3 m-80 -79.44 -4.79 52.77 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -176.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -99.15 -25.59 14.48 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 119.559 1.072 . . . . 0.0 111.169 169.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.753 HD13 ' CD2' ' A' ' 91' ' ' HIS . 40.3 mt . . . . . 0 N--CA 1.45 -0.433 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 174.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 27.2 p . . . . . 0 C--O 1.238 0.457 0 N-CA-C 111.717 0.266 . . . . 0.0 111.717 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -74.53 95.66 0.95 Allowed 'Trans proline' 0 N--CA 1.45 -1.08 0 C-N-CA 123.244 2.63 . . . . 0.0 109.487 178.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 75.6 144.51 0.1 Allowed Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 128.294 2.638 . . . . 0.0 113.964 176.138 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -80.03 -20.56 8.69 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 122.877 2.385 . . . . 0.0 114.201 -178.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -78.12 -18.59 55.46 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 117.295 -1.336 . . . . 0.0 111.527 172.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 tt -60.89 127.0 29.44 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 121.276 1.853 . . . . 0.0 110.831 -174.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 44.6 mm -111.73 118.59 57.96 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.096 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 178.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 63.7 m95 -64.53 152.85 88.47 Favored Pre-proline 0 C--O 1.237 0.411 0 CA-C-O 118.53 -0.748 . . . . 0.0 110.5 173.355 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -70.17 160.2 89.66 Favored 'Cis proline' 0 N--CA 1.458 -0.593 0 C-N-CA 124.697 -0.96 . . . . 0.0 113.717 -1.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -119.6 168.36 11.1 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.972 0.909 . . . . 0.0 109.687 174.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 16.0 mt -140.25 91.25 2.43 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.885 2.074 . . . . 0.0 107.1 -179.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 26.8 tp -68.34 144.86 54.64 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 106.234 -1.765 . . . . 0.0 106.234 160.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -143.11 95.64 2.8 Favored 'General case' 0 CA--C 1.506 -0.743 0 N-CA-C 103.776 -2.675 . . . . 0.0 103.776 167.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -55.06 137.43 46.47 Favored 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 124.717 1.261 . . . . 0.0 109.861 -167.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.8 134.33 56.59 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-O 122.449 1.119 . . . . 0.0 109.051 175.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 97.73 -45.69 1.7 Allowed Glycine 0 CA--C 1.526 0.741 0 C-N-CA 126.251 1.881 . . . . 0.0 111.446 -172.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 66.3 m -68.44 165.59 18.57 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 118.216 1.008 . . . . 0.0 109.983 174.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.559 ' HB3' ' HB1' ' A' ' 84' ' ' ALA . 0.9 OUTLIER -116.48 -29.3 6.2 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.407 1.483 . . . . 0.0 108.267 173.931 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -64.98 144.98 56.93 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 127.426 2.29 . . . . 0.0 109.738 174.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.1 mt -99.98 161.43 13.61 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 125.885 1.674 . . . . 0.0 110.152 -176.289 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -115.05 85.96 13.0 Favored Pre-proline 0 C--O 1.236 0.345 0 C-N-CA 125.201 1.4 . . . . 0.0 108.622 164.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -65.88 135.22 40.33 Favored 'Trans proline' 0 N--CA 1.453 -0.905 0 C-N-CA 121.987 1.791 . . . . 0.0 108.502 168.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.5 mt -134.2 100.45 4.7 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 -177.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.6 mtt180 -58.92 -47.39 85.18 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.144 0.497 . . . . 0.0 111.175 -168.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 66.3 p -141.87 175.98 9.29 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -172.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -54.13 -36.48 63.32 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-O 119.132 -0.461 . . . . 0.0 110.446 166.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -67.38 -16.77 64.43 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -174.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -80.95 -43.93 18.99 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.345 1.058 . . . . 0.0 109.647 171.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 76.4 t-105 -64.89 -37.82 88.91 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.144 0.978 . . . . 0.0 111.877 176.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.9 mm100 -52.61 -48.47 66.31 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 124.666 1.187 . . . . 0.0 109.055 177.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 45.4 mtp85 . . . . . 0 N--CA 1.462 0.135 0 C-N-CA 124.839 1.256 . . . . 0.0 112.236 179.601 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 93.5 mt . . . . . 0 N--CA 1.447 -0.594 0 N-CA-C 105.63 -1.989 . . . . 0.0 105.63 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 26.3 pt20 -157.6 130.33 7.45 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 104.628 -2.36 . . . . 0.0 104.628 -173.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -56.87 132.53 52.79 Favored 'General case' 0 C--O 1.243 0.733 0 N-CA-C 105.554 -2.017 . . . . 0.0 105.554 175.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 100.76 -0.25 55.29 Favored Glycine 0 CA--C 1.534 1.264 0 CA-C-O 118.989 -0.895 . . . . 0.0 115.239 -176.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.58 -19.87 28.59 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 119.874 1.837 . . . . 0.0 115.282 -174.214 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt 62.13 136.37 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 129.786 3.234 . . . . 0.0 113.718 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 8.4 tp -126.76 153.0 46.13 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 174.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 27.5 t -132.67 128.83 57.99 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 N-CA-C 103.783 -2.673 . . . . 0.0 103.783 172.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -97.23 177.76 5.46 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 122.06 0.933 . . . . 0.0 110.748 168.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.1 t -60.65 -19.88 59.37 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.162 1.385 . . . . 0.0 112.763 -178.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -84.32 -14.08 50.66 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 120.535 1.516 . . . . 0.0 113.084 -176.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 67.85 41.65 2.1 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 118.853 0.751 . . . . 0.0 109.72 -158.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 31.6 m170 -91.78 127.64 37.32 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 154.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -90.07 159.44 16.82 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 173.04 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -144.48 161.02 40.11 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 123.43 0.692 . . . . 0.0 110.539 177.301 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 25.7 t -139.07 131.05 36.33 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 128.096 2.558 . . . . 0.0 106.881 177.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.07 130.67 38.69 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 105.936 -1.875 . . . . 0.0 105.936 171.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -123.27 166.83 14.6 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.194 1.397 . . . . 0.0 109.692 177.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -57.74 -27.91 63.42 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 119.861 -1.774 . . . . 0.0 114.86 -166.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -75.39 15.11 0.49 Allowed 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 128.803 2.841 . . . . 0.0 112.369 177.003 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 68.7 9.23 7.22 Favored 'General case' 0 C--N 1.355 0.825 0 C-N-CA 125.61 1.564 . . . . 0.0 113.231 167.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 3.3 p-80 -101.31 159.48 15.23 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 122.386 1.089 . . . . 0.0 111.396 172.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 82.2 m95 -97.49 97.75 9.35 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 105.867 -1.901 . . . . 0.0 105.867 168.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 38.5 t-80 -71.28 143.77 88.63 Favored Pre-proline 0 CA--C 1.538 0.511 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 175.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -68.38 105.83 1.31 Allowed 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.314 2.676 . . . . 0.0 108.97 173.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.67 43.74 0.69 Allowed 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 126.03 1.732 . . . . 0.0 110.892 -176.029 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.531 ' HB1' ' HD2' ' A' ' 72' ' ' PRO . . . 60.73 166.47 0.09 OUTLIER Pre-proline 0 CA--C 1.542 0.637 0 C-N-CA 125.666 1.586 . . . . 0.0 111.942 -167.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.531 ' HD2' ' HB1' ' A' ' 71' ' ' ALA . 57.6 Cg_endo -64.13 177.42 1.99 Allowed 'Trans proline' 0 N--CA 1.451 -1.002 0 C-N-CA 121.122 1.215 . . . . 0.0 111.977 168.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 6.0 tt -122.61 143.46 39.96 Favored Pre-proline 0 CA--C 1.534 0.347 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -79.73 165.27 22.59 Favored 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 122.085 1.857 . . . . 0.0 110.662 -175.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -65.17 -15.63 51.17 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 121.689 1.593 . . . . 0.0 113.248 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -89.32 -27.36 20.57 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.965 0.906 . . . . 0.0 112.925 172.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.54 -36.43 89.36 Favored Glycine 0 C--N 1.344 1.003 0 C-N-CA 124.738 1.161 . . . . 0.0 112.404 -166.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.0 tp -57.61 -48.24 79.96 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 125.687 1.595 . . . . 0.0 108.445 -178.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -62.29 -25.77 68.04 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 118.137 -0.935 . . . . 0.0 112.574 -173.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -72.61 -37.05 68.19 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.486 1.039 . . . . 0.0 111.551 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.4 mp -65.27 -49.98 67.51 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.837 0.855 . . . . 0.0 110.321 173.143 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 15.4 mm -52.19 -42.59 36.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 125.228 1.411 . . . . 0.0 109.178 174.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.4 ttt-85 -52.66 -18.04 1.6 Allowed 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 126.919 2.088 . . . . 0.0 114.61 175.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.559 ' HB1' ' HB3' ' A' ' 23' ' ' ASN . . . -90.1 -51.68 5.34 Favored 'General case' 0 CA--C 1.527 0.079 0 CA-C-N 120.235 1.379 . . . . 0.0 110.859 176.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -57.59 -48.15 80.19 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 121.958 0.885 . . . . 0.0 110.317 175.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 90.3 m -66.86 -36.66 82.82 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 121.52 -0.737 . . . . 0.0 110.877 -177.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.53 -46.72 84.7 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 118.521 0.601 . . . . 0.0 111.176 175.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.5 t -68.55 -31.44 70.66 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -172.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 91.0 mt -79.87 -57.44 3.65 Favored 'General case' 0 N--CA 1.463 0.185 0 O-C-N 121.06 -1.025 . . . . 0.0 110.619 176.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 127.25 39.66 0.37 Allowed Glycine 0 CA--C 1.533 1.18 0 C-N-CA 125.756 1.646 . . . . 0.0 112.853 -177.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 65.8 m-70 . . . . . 0 C--O 1.236 0.355 0 CA-C-N 119.21 1.505 . . . . 0.0 110.511 -177.185 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 . . . . . 0 N--CA 1.454 -0.238 0 CA-C-O 119.686 -0.197 . . . . 0.0 111.458 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 97.7 mt -135.42 116.9 14.76 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 125.231 1.412 . . . . 0.0 109.169 -156.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 10.6 t-80 -75.19 -26.31 58.91 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 172.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 79.1 p -159.21 172.98 17.07 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 119.481 1.037 . . . . 0.0 112.015 177.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 47.5 t -58.14 -43.46 85.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.261 166.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 1.2 ttm -55.85 -50.04 71.68 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 118.995 0.816 . . . . 0.0 110.355 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.41 -29.85 69.46 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 120.704 -0.398 . . . . 0.0 110.168 -178.31 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -69.27 -42.77 75.11 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 124.802 1.241 . . . . 0.0 112.823 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 32.7 mm -54.95 -39.86 51.0 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 172.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -69.34 -44.6 71.32 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 119.438 -0.315 . . . . 0.0 111.032 -178.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -57.71 -44.47 85.94 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.257 1.023 . . . . 0.0 111.001 176.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 12.4 mt -54.61 -35.97 63.97 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 124.929 1.292 . . . . 0.0 112.136 173.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -88.58 0.62 56.17 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.438 1.495 . . . . 0.0 112.516 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -112.92 3.52 16.34 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.872 1.669 . . . . 0.0 112.281 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 15.5 mt . . . . . 0 CA--C 1.527 0.07 0 C-N-CA 123.439 0.695 . . . . 0.0 109.809 167.074 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 19.5 p . . . . . 0 C--O 1.237 0.411 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -81.9 83.32 2.11 Favored 'Trans proline' 0 N--CA 1.444 -1.44 0 C-N-CA 121.723 1.616 . . . . 0.0 109.172 173.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 74.9 149.33 0.12 Allowed Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 127.706 2.402 . . . . 0.0 111.164 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -73.42 -34.0 6.34 Favored 'Trans proline' 0 CA--C 1.534 0.497 0 C-N-CA 122.007 1.804 . . . . 0.0 112.806 173.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -76.47 -11.89 59.95 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 118.807 0.73 . . . . 0.0 112.892 -171.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 tt -61.2 142.37 56.83 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.302 0.641 . . . . 0.0 110.066 167.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 34.1 mm -124.96 117.77 51.14 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 173.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 81.4 m95 -61.22 151.63 75.25 Favored Pre-proline 0 C--O 1.235 0.323 0 C-N-CA 122.771 0.429 . . . . 0.0 110.779 177.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -73.24 168.14 76.87 Favored 'Cis proline' 0 N--CA 1.457 -0.637 0 C-N-CA 125.122 -0.783 . . . . 0.0 114.027 -1.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -137.06 172.91 12.3 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.332 1.053 . . . . 0.0 110.685 177.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 17.2 mt -141.41 105.97 4.88 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 126.246 1.818 . . . . 0.0 108.681 -171.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 32.5 tp -87.92 150.35 23.53 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 125.262 1.425 . . . . 0.0 109.913 174.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -144.53 83.19 1.71 Allowed 'General case' 0 C--O 1.239 0.501 0 CA-C-N 120.176 1.353 . . . . 0.0 110.391 172.567 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -47.77 140.91 5.99 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 125.889 1.676 . . . . 0.0 113.296 -170.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -62.94 117.52 6.52 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.612 0.72 . . . . 0.0 110.642 -179.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 119.39 -62.21 0.47 Allowed Glycine 0 N--CA 1.451 -0.355 0 N-CA-C 108.575 -1.81 . . . . 0.0 108.575 -170.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -76.1 -179.75 5.16 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 123.434 1.588 . . . . 0.0 112.663 -166.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -124.78 -16.72 6.1 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 126.075 1.75 . . . . 0.0 109.319 176.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -77.47 109.98 11.86 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 -174.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.521 HD12 ' HB2' ' A' ' 85' ' ' HIS . 0.5 OUTLIER -65.65 148.3 51.98 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 119.604 -0.838 . . . . 0.0 108.947 172.419 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -104.34 87.68 1.78 Allowed Pre-proline 0 N--CA 1.447 -0.619 0 C-N-CA 126.314 1.846 . . . . 0.0 106.45 173.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -61.91 132.45 39.73 Favored 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 121.949 1.766 . . . . 0.0 108.526 170.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -118.61 103.28 9.56 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.923 1.289 . . . . 0.0 107.577 174.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 30.0 mtt180 -66.87 -38.99 87.37 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 119.415 1.007 . . . . 0.0 112.754 -169.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 15.5 p -152.55 166.81 30.87 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 126.367 1.867 . . . . 0.0 106.95 -170.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -47.75 -37.85 14.24 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.501 1.046 . . . . 0.0 112.636 175.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.02 -17.9 29.53 Favored 'General case' 0 C--O 1.231 0.095 0 C-N-CA 125.354 1.462 . . . . 0.0 114.275 -177.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -87.09 -47.28 9.04 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.479 1.912 . . . . 0.0 110.274 -175.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 53.4 t-105 -58.21 -34.69 70.67 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 120.659 -1.276 . . . . 0.0 110.267 176.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -51.21 -48.35 62.04 Favored 'General case' 0 C--N 1.341 0.234 0 C-N-CA 123.635 0.774 . . . . 0.0 110.105 173.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 5.2 mtt180 . . . . . 0 CA--C 1.517 -0.322 0 C-N-CA 125.711 1.604 . . . . 0.0 112.225 -169.377 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.521 ' N ' HE21 ' A' ' 46' ' ' GLN . 31.2 mt . . . . . 0 CA--C 1.523 -0.095 0 CA-C-O 121.235 0.54 . . . . 0.0 112.373 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.521 HE21 ' N ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -104.11 165.66 10.91 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.301 1.04 . . . . 0.0 111.06 -169.896 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 17.7 m-85 -73.08 79.29 1.23 Allowed 'General case' 0 C--O 1.234 0.264 0 C-N-CA 125.485 1.514 . . . . 0.0 109.711 177.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 150.84 -0.75 0.37 Allowed Glycine 0 N--CA 1.446 -0.696 0 CA-C-N 115.003 -0.999 . . . . 0.0 113.022 -167.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.04 -9.4 38.76 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 119.41 1.605 . . . . 0.0 114.621 -168.172 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt 44.23 126.44 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.785 1 C-N-CA 132.993 4.517 . . . . 0.0 114.837 179.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.0 tp -120.04 151.21 39.34 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 124.283 1.033 . . . . 0.0 108.252 170.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.41 HG11 HD13 ' A' ' 73' ' ' LEU . 33.8 t -134.8 146.27 31.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 105.535 -2.024 . . . . 0.0 105.535 161.496 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -120.95 -171.11 2.13 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 127.782 2.433 . . . . 0.0 110.701 178.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 88.8 p -63.93 -29.17 70.37 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -72.47 -14.72 61.74 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 124.121 0.968 . . . . 0.0 112.305 -178.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.63 ' CD1' HD22 ' A' ' 73' ' ' LEU . 48.3 m-85 51.15 57.33 6.75 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.196 0.999 . . . . 0.0 111.406 -177.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 11.0 m170 -120.75 13.02 11.49 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.377 1.071 . . . . 0.0 113.693 -171.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 57.0 m 43.05 124.99 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.541 1 C-N-CA 133.624 4.77 . . . . 0.0 113.573 176.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -126.54 141.88 51.72 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 121.362 -0.836 . . . . 0.0 109.171 178.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 30.5 t -130.9 146.13 34.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 C-N-CA 127.243 2.217 . . . . 0.0 105.698 169.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 21.4 tp -77.19 139.1 39.81 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 124.184 0.994 . . . . 0.0 108.607 177.104 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -108.0 167.2 10.16 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 125.789 1.636 . . . . 0.0 109.67 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -69.72 -9.85 56.02 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.82 0.848 . . . . 0.0 112.493 176.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.3 t0 -81.78 6.6 15.01 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.562 1.545 . . . . 0.0 111.087 166.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 53.01 8.25 0.09 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 128.053 2.541 . . . . 0.0 114.29 -169.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.2 p-80 -79.26 165.91 22.71 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 119.435 1.016 . . . . 0.0 109.405 169.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 75.6 m95 -102.45 122.31 44.07 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 106.838 -1.541 . . . . 0.0 106.838 170.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 63.0 t60 -98.99 143.68 26.82 Favored Pre-proline 0 CA--C 1.536 0.431 0 CA-C-O 118.379 -0.819 . . . . 0.0 109.186 -176.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -74.52 125.26 9.46 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 124.109 3.206 . . . . 0.0 110.754 173.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -116.72 39.33 3.21 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 125.021 1.328 . . . . 0.0 110.426 -168.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 67.61 164.35 0.13 Allowed Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 127.98 2.512 . . . . 0.0 111.949 -178.162 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -69.7 174.27 9.71 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.201 1.934 . . . . 0.0 114.26 -172.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.63 HD22 ' CD1' ' A' ' 56' ' ' PHE . 8.3 tt -128.75 143.64 49.32 Favored Pre-proline 0 CA--C 1.542 0.652 0 C-N-CA 126.663 1.985 . . . . 0.0 108.411 -175.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.463 ' O ' HD23 ' A' ' 73' ' ' LEU . 73.2 Cg_endo -85.6 165.45 10.57 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 123.14 2.56 . . . . 0.0 112.977 -178.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -60.15 -14.06 26.94 Favored 'Trans proline' 0 CA--C 1.531 0.361 0 C-N-CA 123.383 2.722 . . . . 0.0 114.77 177.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -101.31 -14.24 17.71 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.251 1.82 . . . . 0.0 112.493 177.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -75.22 -25.59 68.25 Favored Glycine 0 CA--C 1.53 1.003 0 O-C-N 121.133 -0.98 . . . . 0.0 112.916 -177.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 23.0 tp -50.75 -48.69 59.07 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 118.359 1.08 . . . . 0.0 109.333 166.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -68.31 -21.45 64.77 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.931 -168.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -69.31 -43.55 73.54 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 120.398 1.454 . . . . 0.0 111.565 172.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -60.34 -55.4 34.15 Favored 'General case' 0 CA--C 1.522 -0.098 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 175.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.8 mm -58.3 -33.28 47.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 123.609 0.763 . . . . 0.0 110.605 -176.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.9 -35.56 45.86 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 119.429 1.013 . . . . 0.0 112.219 175.668 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.26 -61.45 2.35 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 119.212 0.915 . . . . 0.0 109.365 176.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.521 ' HB2' HD12 ' A' ' 25' ' ' LEU . 10.2 t60 -57.98 -36.56 72.78 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.876 0.871 . . . . 0.0 112.194 -175.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 96.7 m -70.39 -54.37 12.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 118.358 -0.83 . . . . 0.0 110.973 175.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.14 -24.99 65.06 Favored 'General case' 0 C--O 1.23 0.074 0 CA-C-N 118.862 0.755 . . . . 0.0 112.03 -171.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.4 t -76.85 -15.37 59.73 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 118.653 -0.689 . . . . 0.0 110.755 178.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.586 HD12 ' CE1' ' A' ' 91' ' ' HIS . 83.6 mt -114.77 -58.28 2.16 Favored 'General case' 0 C--N 1.343 0.324 0 CA-C-N 119.636 1.107 . . . . 0.0 110.6 -174.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 149.36 5.55 0.22 Allowed Glycine 0 CA--C 1.528 0.901 0 CA-C-O 118.93 -0.928 . . . . 0.0 113.9 -173.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . 0.782 ' CE1' HD13 ' A' ' 112' ' ' LEU . 30.3 m170 . . . . . 0 C--O 1.238 0.453 0 CA-C-N 119.511 1.656 . . . . 0.0 110.74 -161.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 1.2 m80 . . . . . 0 CA--C 1.532 0.256 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.456 HD13 ' HB2' ' A' ' 105' ' ' ALA . 81.6 mt -147.19 133.67 19.74 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 125.829 1.652 . . . . 0.0 108.102 -173.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 47.1 t-80 -67.6 -42.9 81.72 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 124.294 0.996 . . . . 0.0 111.807 179.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -170.2 -179.2 3.03 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.243 1.417 . . . . 0.0 109.157 -173.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 16.0 t -59.26 -40.62 81.71 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 C-N-CA 123.824 0.85 . . . . 0.0 110.818 -175.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -54.15 -45.67 72.08 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.875 0.87 . . . . 0.0 109.829 178.401 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -63.12 -41.53 99.36 Favored 'General case' 0 C--N 1.333 -0.115 0 C-N-CA 124.746 1.218 . . . . 0.0 110.564 -178.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.456 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -60.56 -50.17 74.63 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 124.224 1.01 . . . . 0.0 111.135 178.392 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 14.0 mm -66.31 -37.09 78.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -174.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -61.91 -47.97 82.54 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 118.763 0.711 . . . . 0.0 110.168 174.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -52.83 -63.7 1.06 Allowed 'General case' 0 C--N 1.342 0.257 0 C-N-CA 125.323 1.449 . . . . 0.0 111.59 179.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.7 mp -51.43 -47.0 63.15 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.702 1.201 . . . . 0.0 110.993 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -73.28 -18.36 61.22 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 121.663 -0.648 . . . . 0.0 112.377 -178.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -85.48 -22.85 28.05 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.357 1.063 . . . . 0.0 111.418 176.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.782 HD13 ' CE1' ' A' ' 91' ' ' HIS . 22.5 mt . . . . . 0 N--CA 1.453 -0.318 0 C-N-CA 124.133 0.973 . . . . 0.0 109.065 172.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 10.3 p . . . . . 0 CA--C 1.54 0.588 0 CA-C-O 119.227 -0.416 . . . . 0.0 110.771 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -79.31 90.2 1.29 Allowed 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 123.865 3.043 . . . . 0.0 110.258 -178.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 74.54 144.72 0.11 Allowed Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 127.898 2.479 . . . . 0.0 111.194 -175.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -77.94 -20.41 11.69 Favored 'Trans proline' 0 CA--C 1.535 0.534 0 C-N-CA 122.349 2.032 . . . . 0.0 113.507 -178.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -90.22 -15.89 30.51 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.256 0.622 . . . . 0.0 112.634 -175.088 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.8 tt -62.74 142.49 58.12 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 118.936 0.789 . . . . 0.0 109.806 170.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 18.2 mm -126.95 136.47 60.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 C-N-CA 124.194 0.998 . . . . 0.0 108.607 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 75.1 m95 -77.94 156.86 79.56 Favored Pre-proline 0 CA--C 1.543 0.693 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 -178.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -67.34 163.33 74.14 Favored 'Cis proline' 0 N--CA 1.458 -0.568 0 C-N-CA 124.633 -0.986 . . . . 0.0 113.355 -9.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -131.79 171.22 13.79 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.218 1.807 . . . . 0.0 110.016 176.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.7 mt -141.52 107.13 5.07 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 125.611 1.564 . . . . 0.0 107.63 -174.256 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.1 tp -84.14 151.27 24.99 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 169.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.453 ' HE3' ' O ' ' A' ' 22' ' ' CYS . 0.1 OUTLIER -142.58 91.5 2.32 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 171.894 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -48.31 136.0 12.92 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 124.522 1.139 . . . . 0.0 110.939 -168.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -66.28 91.5 0.17 Allowed 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 122.122 0.963 . . . . 0.0 111.808 -172.172 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 137.73 -40.43 1.49 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 124.942 1.258 . . . . 0.0 110.308 -178.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.453 ' O ' ' HE3' ' A' ' 18' ' ' LYS . 62.7 m -65.71 173.16 2.97 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 121.544 0.687 . . . . 0.0 110.281 177.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -122.04 -32.36 3.72 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 176.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -60.76 137.89 58.16 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 124.682 1.193 . . . . 0.0 108.417 170.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.4 mt -87.46 154.07 20.93 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 124.427 1.091 . . . . 0.0 108.987 168.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -111.91 86.72 7.71 Favored Pre-proline 0 CA--C 1.542 0.64 0 N-CA-C 105.847 -1.908 . . . . 0.0 105.847 175.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -60.56 140.74 92.81 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 123.936 3.091 . . . . 0.0 109.412 174.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.5 mt -132.89 96.69 3.84 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 106.654 -1.61 . . . . 0.0 106.654 -178.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.8 mtt-85 -53.7 -45.6 70.45 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 124.27 1.028 . . . . 0.0 110.882 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.4 t -157.19 178.14 10.68 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 -172.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -56.84 -34.65 67.97 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 123.716 0.807 . . . . 0.0 111.696 171.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -63.07 -17.74 62.61 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.539 1.063 . . . . 0.0 111.601 177.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -81.55 -44.71 16.93 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.689 1.596 . . . . 0.0 109.03 175.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 57.6 t-105 -57.72 -33.01 67.97 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.051 1.741 . . . . 0.0 112.481 174.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 -65.03 -50.25 66.96 Favored 'General case' 0 C--O 1.232 0.155 0 O-C-N 120.436 -1.415 . . . . 0.0 110.769 172.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 50.6 mtp85 . . . . . 0 C--O 1.227 -0.119 0 CA-C-O 117.207 -1.378 . . . . 0.0 112.091 -175.802 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 81.1 mt . . . . . 0 C--O 1.235 0.323 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -136.95 157.58 46.42 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 124.621 1.168 . . . . 0.0 109.545 -173.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -65.2 121.33 14.52 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 107.513 -1.291 . . . . 0.0 107.513 179.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 97.1 10.77 54.37 Favored Glycine 0 CA--C 1.535 1.299 0 CA-C-O 117.482 -1.732 . . . . 0.0 114.404 -177.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.3 -13.67 41.25 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-N 120.441 2.121 . . . . 0.0 115.466 178.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt 47.73 144.46 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.531 1 C-N-CA 134.815 5.246 . . . . 0.0 114.632 -176.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 14.8 mt -126.58 156.21 41.23 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 166.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 17.3 t -130.57 141.8 45.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 N-CA-C 104.552 -2.388 . . . . 0.0 104.552 163.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -98.66 179.78 4.56 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.276 1.03 . . . . 0.0 110.539 173.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.6 m -61.98 -3.09 1.07 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 115.881 1.808 . . . . 0.0 115.881 174.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 -120.79 16.2 11.84 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 127.04 2.136 . . . . 0.0 110.368 -176.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 65.33 13.94 9.11 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.819 2.048 . . . . 0.0 112.874 175.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 31.1 m170 -69.04 110.0 4.27 Favored 'General case' 0 C--N 1.329 -0.285 0 O-C-N 120.191 -1.568 . . . . 0.0 109.121 174.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -71.22 143.74 50.34 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 119.501 1.046 . . . . 0.0 108.76 167.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -135.65 159.49 41.47 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 125.397 1.479 . . . . 0.0 109.602 -179.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 30.3 t -141.64 141.33 30.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 C-N-CA 128.158 2.583 . . . . 0.0 105.961 -174.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 22.8 tp -94.42 132.73 38.76 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 128.299 2.64 . . . . 0.0 105.657 174.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 73.3 mt-10 -128.99 174.72 9.28 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.291 1.036 . . . . 0.0 112.11 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -68.38 -18.5 64.48 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 125.622 1.569 . . . . 0.0 114.516 -166.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -77.0 12.34 1.43 Allowed 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.067 1.347 . . . . 0.0 111.256 174.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 45.91 48.48 12.16 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 126.241 1.816 . . . . 0.0 109.693 -170.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -120.44 161.51 21.11 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.544 0.687 . . . . 0.0 110.876 162.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 81.6 m95 -94.75 154.56 17.23 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 106.043 -1.836 . . . . 0.0 106.043 158.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -142.46 161.34 50.45 Favored Pre-proline 0 CA--C 1.54 0.569 0 C-N-CA 123.935 0.894 . . . . 0.0 111.079 -176.02 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.04 134.42 27.35 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 124.313 3.342 . . . . 0.0 111.153 172.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -129.01 21.11 5.83 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.234 1.414 . . . . 0.0 112.833 -176.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 75.59 154.5 0.15 Allowed Pre-proline 0 CA--C 1.539 0.551 0 C-N-CA 131.479 3.912 . . . . 0.0 113.496 -177.22 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -72.0 163.58 38.34 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 121.756 1.638 . . . . 0.0 113.419 -176.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.4 tt -102.37 143.58 26.9 Favored Pre-proline 0 CA--C 1.545 0.762 0 C-N-CA 126.263 1.825 . . . . 0.0 109.273 -173.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -83.01 166.82 14.54 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 123.954 3.103 . . . . 0.0 111.706 -176.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -64.14 -21.27 67.84 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 121.626 1.551 . . . . 0.0 112.96 -175.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -90.34 -20.45 22.85 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.652 1.581 . . . . 0.0 112.928 175.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.02 -32.55 84.53 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-N 119.518 1.054 . . . . 0.0 111.104 -175.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 32.5 tp -59.67 -51.23 70.67 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.065 0.946 . . . . 0.0 108.511 178.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -61.28 -25.05 66.84 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.274 1.829 . . . . 0.0 111.061 178.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -76.43 -47.5 22.87 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.524 1.056 . . . . 0.0 111.029 176.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.42 HD13 ' HA ' ' A' ' 81' ' ' LEU . 1.4 mm? -61.2 -50.35 73.47 Favored 'General case' 0 CA--C 1.521 -0.16 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 177.24 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.7 mm -53.73 -42.24 50.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 C-N-CA 124.022 0.929 . . . . 0.0 109.672 -179.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.9 ttt85 -51.38 -38.57 54.01 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 120.017 1.28 . . . . 0.0 113.614 177.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.15 -49.64 75.06 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 119.774 1.17 . . . . 0.0 109.987 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 24.0 t60 -60.69 -46.0 92.05 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.863 0.865 . . . . 0.0 109.716 176.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 73.2 m -65.04 -34.47 78.51 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 118.297 -0.859 . . . . 0.0 111.886 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -71.45 -40.82 70.11 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 119.019 0.827 . . . . 0.0 111.122 -177.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 8.6 t -71.42 -35.04 70.82 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 118.989 -0.529 . . . . 0.0 110.187 -175.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 64.3 mt -78.42 -47.13 18.2 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 175.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 99.04 53.33 1.18 Allowed Glycine 0 CA--C 1.527 0.838 0 C-N-CA 127.247 2.356 . . . . 0.0 110.625 -178.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 35.3 m-70 . . . . . 0 CA--C 1.536 0.428 0 C-N-CA 126.118 1.767 . . . . 0.0 111.688 -177.913 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 8.5 m80 . . . . . 0 C--O 1.232 0.16 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.522 HD13 ' HB2' ' A' ' 105' ' ' ALA . 94.1 mt -145.5 154.41 42.18 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 126.205 1.802 . . . . 0.0 108.503 -165.05 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -96.41 -28.78 14.29 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.127 -0.488 . . . . 0.0 112.271 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.6 t -171.63 179.85 2.72 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.432 1.493 . . . . 0.0 108.508 -177.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 60.6 t -65.21 -37.09 79.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 O-C-N 121.325 -0.859 . . . . 0.0 110.989 -177.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 3.7 tpt -59.05 -38.56 79.65 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 121.916 -0.49 . . . . 0.0 109.919 177.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -63.73 -44.31 93.94 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 124.27 1.028 . . . . 0.0 109.166 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.522 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -55.67 -52.0 65.32 Favored 'General case' 0 C--N 1.34 0.195 0 C-N-CA 125.599 1.56 . . . . 0.0 112.404 -178.221 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 30.0 mm -61.98 -44.08 98.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 -175.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.68 -40.78 92.71 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.151 0.58 . . . . 0.0 110.418 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -55.28 -55.17 34.5 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 124.318 1.047 . . . . 0.0 109.686 176.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 6.8 mt -61.64 -45.57 93.48 Favored 'General case' 0 CA--C 1.517 -0.315 0 O-C-N 124.182 0.926 . . . . 0.0 110.679 -176.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 -59.35 -43.41 92.81 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 118.988 -0.53 . . . . 0.0 110.065 179.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.8 -12.76 61.86 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 -177.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 57.2 mt . . . . . 0 N--CA 1.465 0.3 0 CA-C-N 120.155 1.343 . . . . 0.0 109.162 177.254 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.236 0.381 0 CA-C-O 118.625 -0.703 . . . . 0.0 110.816 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -68.4 -54.66 0.28 Allowed 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.598 2.199 . . . . 0.0 111.931 176.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 20.3 t-80 -161.94 144.21 8.71 Favored Pre-proline 0 CA--C 1.536 0.427 0 CA-C-N 119.853 1.206 . . . . 0.0 108.661 174.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -73.64 -1.73 11.16 Favored 'Trans proline' 0 CA--C 1.536 0.609 0 C-N-CA 122.93 2.42 . . . . 0.0 114.216 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -113.11 -3.93 13.89 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.743 1.217 . . . . 0.0 112.23 177.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.7 tt -66.77 117.02 8.31 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 163.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 29.4 mm -100.05 103.9 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 177.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 71.9 m95 -53.47 150.51 12.28 Favored Pre-proline 0 CA--C 1.533 0.292 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.761 176.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -68.88 167.91 66.2 Favored 'Cis proline' 0 N--CA 1.456 -0.696 0 N-CA-C 114.878 1.069 . . . . 0.0 114.878 -0.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -139.23 167.78 21.3 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 124.831 1.252 . . . . 0.0 110.741 -179.483 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.5 mt -140.53 114.32 8.9 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 125.734 1.613 . . . . 0.0 108.488 -172.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.481 HD11 ' HB3' ' A' ' 49' ' ' ASP . 18.7 tp -95.7 143.77 26.67 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.602 1.561 . . . . 0.0 109.015 178.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -146.21 98.05 3.03 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 119.616 1.098 . . . . 0.0 110.769 175.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -58.87 160.31 5.99 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-O 122.687 1.232 . . . . 0.0 112.658 -173.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -76.12 99.87 4.8 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 122.63 1.205 . . . . 0.0 111.981 174.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 126.89 -39.43 1.97 Allowed Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 126.229 1.871 . . . . 0.0 108.506 169.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 41.6 m -65.67 165.07 13.18 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 124.568 1.147 . . . . 0.0 109.647 174.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 -122.16 -28.16 4.42 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 124.914 1.286 . . . . 0.0 109.539 -178.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -60.82 115.11 3.43 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 127.825 2.45 . . . . 0.0 109.177 -178.048 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -72.4 147.61 46.04 Favored 'General case' 0 N--CA 1.463 0.197 0 O-C-N 121.103 -0.998 . . . . 0.0 109.496 172.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.06 87.61 9.08 Favored Pre-proline 0 CA--C 1.535 0.369 0 C-N-CA 125.48 1.512 . . . . 0.0 108.945 176.084 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -63.48 127.54 20.15 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 122.641 2.227 . . . . 0.0 110.73 172.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -114.72 107.75 15.87 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 125.996 1.718 . . . . 0.0 107.604 169.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.7 mtt-85 -61.85 -45.79 92.29 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.045 0.384 . . . . 0.0 111.186 -178.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 13.3 t -146.85 -176.1 5.07 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 121.918 0.866 . . . . 0.0 110.54 174.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -54.44 -38.35 66.21 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 124.789 1.236 . . . . 0.0 110.085 -179.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.73 -19.85 63.54 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 121.423 0.63 . . . . 0.0 111.498 -177.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -78.47 -35.12 47.05 Favored 'General case' 0 CA--C 1.521 -0.164 0 O-C-N 120.151 -1.593 . . . . 0.0 109.923 175.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 49.9 t-105 -64.03 -34.93 79.12 Favored 'General case' 0 C--O 1.234 0.266 0 O-C-N 121.455 -0.778 . . . . 0.0 110.615 170.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -57.5 -57.15 13.96 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-O 118.834 -0.603 . . . . 0.0 109.771 168.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.552 1.025 0 C-N-CA 117.543 -1.663 . . . . 0.0 109.632 -168.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 57.9 mt . . . . . 0 N--CA 1.454 -0.243 0 N-CA-C 107.646 -1.242 . . . . 0.0 107.646 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -129.7 147.21 51.46 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.656 1.582 . . . . 0.0 107.943 -177.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.591 ' HA ' HD13 ' A' ' 61' ' ' LEU . 40.3 m-85 -67.16 91.32 0.22 Allowed 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 124.858 1.263 . . . . 0.0 110.629 -167.435 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 140.48 15.93 0.48 Allowed Glycine 0 CA--C 1.528 0.889 0 C-N-CA 124.203 0.906 . . . . 0.0 113.336 -179.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.481 ' HB3' HD11 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -56.13 -9.97 0.74 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 127.768 2.427 . . . . 0.0 115.321 171.779 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.2 ttmt 44.42 115.69 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 130.808 3.643 . . . . 0.0 113.737 175.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 16.1 mt -104.42 155.19 19.0 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 167.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 23.7 t -136.81 142.94 36.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 N-CA-C 105.952 -1.87 . . . . 0.0 105.952 160.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.68 -170.56 1.78 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.829 1.652 . . . . 0.0 111.018 179.126 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.6 m -72.55 -15.69 61.76 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 176.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 -80.14 -3.95 50.93 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.829 1.251 . . . . 0.0 112.469 168.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 63.88 19.49 11.76 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.521 1.128 . . . . 0.0 109.88 -170.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 66.6 m170 -67.06 107.44 2.28 Favored 'General case' 0 CA--C 1.518 -0.266 0 O-C-N 120.215 -1.553 . . . . 0.0 106.918 170.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -74.04 153.86 39.49 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 121.952 0.882 . . . . 0.0 109.577 168.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -135.4 167.95 20.11 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 125.784 1.633 . . . . 0.0 108.511 -178.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 53.4 t -145.21 142.01 22.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 104.772 -2.307 . . . . 0.0 104.772 172.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.591 HD13 ' HA ' ' A' ' 47' ' ' TYR . 0.1 OUTLIER -81.6 124.53 29.62 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 106.379 -1.712 . . . . 0.0 106.379 170.461 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -109.21 161.25 15.41 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 118.516 0.598 . . . . 0.0 109.533 -178.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -55.84 -14.84 2.63 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -175.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.93 -11.04 57.98 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.937 1.295 . . . . 0.0 112.78 170.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 74.45 8.16 4.49 Favored 'General case' 0 C--N 1.351 0.643 0 C-N-CA 126.236 1.815 . . . . 0.0 111.193 -165.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -94.26 164.35 13.07 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 118.783 0.72 . . . . 0.0 111.403 177.081 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -107.96 107.28 17.91 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 107.645 -1.242 . . . . 0.0 107.645 173.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 -79.98 143.58 57.72 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -71.78 105.27 1.76 Allowed 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 124.606 3.537 . . . . 0.0 109.815 170.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.92 28.69 0.09 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.061 1.344 . . . . 0.0 111.559 170.026 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.494 ' HB1' ' HD2' ' A' ' 72' ' ' PRO . . . 67.8 166.71 0.12 Allowed Pre-proline 0 CA--C 1.539 0.53 0 C-N-CA 125.79 1.636 . . . . 0.0 111.602 -178.466 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.494 ' HD2' ' HB1' ' A' ' 71' ' ' ALA . 72.0 Cg_endo -64.36 162.88 28.62 Favored 'Trans proline' 0 N--CA 1.45 -1.052 0 C-N-CA 120.47 0.78 . . . . 0.0 110.925 168.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 20.7 tp -122.67 144.63 43.01 Favored Pre-proline 0 N--CA 1.448 -0.575 0 C-N-CA 126.717 2.007 . . . . 0.0 106.262 -178.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -62.24 160.68 29.8 Favored 'Trans proline' 0 N--CA 1.453 -0.91 0 C-N-CA 121.608 1.538 . . . . 0.0 110.445 174.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -59.97 -25.12 78.72 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 122.28 1.987 . . . . 0.0 112.487 179.168 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -89.2 -20.04 24.68 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 126.549 1.94 . . . . 0.0 109.764 -174.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.06 -23.17 78.37 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 123.814 0.721 . . . . 0.0 112.432 176.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 27.9 tp -55.66 -46.99 77.42 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.311 1.044 . . . . 0.0 109.847 169.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -58.45 -26.17 63.03 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.452 1.501 . . . . 0.0 111.379 -175.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -74.79 -24.35 58.64 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.18 1.392 . . . . 0.0 113.158 177.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 93.7 mt -84.94 -53.56 5.23 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 175.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.7 mm -56.74 -28.06 27.11 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 125.395 1.478 . . . . 0.0 110.258 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -44.14 -46.45 8.75 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 125.581 1.552 . . . . 0.0 111.172 174.418 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.73 -48.77 77.77 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 123.525 0.73 . . . . 0.0 111.718 -176.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.441 ' NE2' HD12 ' A' ' 112' ' ' LEU . 13.0 t60 -59.32 -46.62 88.11 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.368 0.667 . . . . 0.0 109.716 177.694 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 78.2 m -68.92 -31.99 71.28 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 120.896 -1.127 . . . . 0.0 111.129 -178.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -80.63 -12.51 59.49 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 125.111 1.365 . . . . 0.0 113.557 -179.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.0 t -95.57 -4.41 44.7 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.107 0.867 . . . . 0.0 110.981 170.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 88.9 mt -122.72 -46.84 2.1 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 119.89 1.223 . . . . 0.0 111.66 -174.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 119.95 57.59 0.25 Allowed Glycine 0 CA--C 1.528 0.891 0 C-N-CA 125.239 1.399 . . . . 0.0 112.529 178.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.47 0.556 0 CA-C-N 118.975 1.388 . . . . 0.0 112.674 -179.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 17.2 t-160 . . . . . 0 CA--C 1.519 -0.245 0 CA-C-O 119.244 -0.408 . . . . 0.0 111.86 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.614 HD13 ' HB2' ' A' ' 105' ' ' ALA . 84.2 mt -138.85 146.76 41.6 Favored 'General case' 0 CA--C 1.514 -0.43 0 C-N-CA 124.647 1.179 . . . . 0.0 107.907 169.306 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 -79.45 -36.31 39.06 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 124.557 1.143 . . . . 0.0 112.539 -179.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 24.2 p -170.64 174.0 5.19 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 126.18 1.792 . . . . 0.0 108.625 -177.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 68.7 t -62.62 -45.74 98.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-O 118.714 -0.66 . . . . 0.0 109.929 177.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 46.8 tpp -62.77 -46.05 89.82 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.843 1.201 . . . . 0.0 110.155 -177.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.29 -35.44 69.8 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 178.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.614 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -62.42 -41.77 98.94 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 123.652 0.781 . . . . 0.0 112.492 174.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 29.1 mm -56.02 -49.99 72.33 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-N 119.364 0.984 . . . . 0.0 108.889 -177.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.67 -40.73 63.47 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.123 -176.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.445 ' CE2' HD11 ' A' ' 112' ' ' LEU . 90.4 t80 -50.29 -59.16 4.24 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.535 0.734 . . . . 0.0 111.454 173.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 74.4 mt -58.29 -35.57 72.0 Favored 'General case' 0 CA--C 1.522 -0.125 0 C-N-CA 125.289 1.436 . . . . 0.0 112.159 -174.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -69.16 -46.12 68.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 119.227 -0.416 . . . . 0.0 110.355 174.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -69.61 -11.65 61.01 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.132 0.973 . . . . 0.0 112.829 -178.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.445 HD11 ' CE2' ' A' ' 108' ' ' PHE . 19.8 mt . . . . . 0 N--CA 1.454 -0.263 0 CA-C-N 119.279 0.945 . . . . 0.0 110.687 169.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 14.2 p . . . . . 0 C--O 1.239 0.519 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -97.47 84.06 0.07 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.173 0 C-N-CA 122.61 2.207 . . . . 0.0 110.588 -177.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 75.4 143.66 0.1 OUTLIER Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 128.91 2.884 . . . . 0.0 110.455 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -84.11 -15.89 6.47 Favored 'Trans proline' 0 CA--C 1.535 0.548 0 C-N-CA 122.921 2.414 . . . . 0.0 112.21 175.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.9 -13.52 59.98 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.736 0.814 . . . . 0.0 110.559 175.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 tt -68.43 130.97 44.46 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-N 118.385 0.539 . . . . 0.0 110.542 169.448 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 8.0 mm -119.08 102.55 13.16 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 126.602 1.961 . . . . 0.0 108.258 -179.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 84.5 m95 -58.84 148.83 67.42 Favored Pre-proline 0 CA--C 1.54 0.566 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 -175.327 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.99 172.45 56.93 Favored 'Cis proline' 0 N--CA 1.455 -0.776 0 N-CA-C 114.271 0.835 . . . . 0.0 114.271 5.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.449 ' HB1' HD22 ' A' ' 51' ' ' LEU . . . -144.17 166.11 25.96 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.306 172.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.9 mt -132.91 105.97 7.42 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 125.29 1.436 . . . . 0.0 107.333 -178.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 29.9 tp -66.9 142.03 57.44 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 171.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.14 94.53 2.54 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 107.47 -1.307 . . . . 0.0 107.47 165.365 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -59.32 155.9 13.7 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 126.013 1.725 . . . . 0.0 110.145 -173.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -63.79 116.47 5.78 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 127.453 2.301 . . . . 0.0 109.726 -173.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 79.9 -11.22 35.79 Favored Glycine 0 CA--C 1.528 0.898 0 CA-C-O 118.523 -1.154 . . . . 0.0 113.516 178.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 50.7 m -72.05 178.14 3.96 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.644 1.722 . . . . 0.0 109.688 167.419 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -142.47 -22.13 0.67 Allowed 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 125.166 1.386 . . . . 0.0 111.704 -178.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.49 148.14 49.92 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 166.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -104.96 150.09 25.2 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 170.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.448 HD22 ' HA ' ' A' ' 26' ' ' LEU . 0.2 OUTLIER -106.75 88.54 3.58 Favored Pre-proline 0 C--O 1.234 0.254 0 C-N-CA 126.923 2.089 . . . . 0.0 110.883 175.372 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -56.82 131.32 44.85 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.579 2.186 . . . . 0.0 110.337 177.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -123.55 97.63 5.47 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 125.91 1.684 . . . . 0.0 107.477 172.09 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.5 mtt85 -56.18 -45.54 79.71 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 118.584 0.629 . . . . 0.0 110.939 177.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 12.3 t -148.82 -175.6 5.01 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 121.737 0.779 . . . . 0.0 110.054 173.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -54.12 -34.58 60.66 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.176 1.39 . . . . 0.0 111.61 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -61.22 -41.23 96.48 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.216 0.532 . . . . 0.0 109.878 178.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.422 ' HA ' ' HD2' ' A' ' 36' ' ' ARG . 16.9 m-20 -70.49 -27.87 64.54 Favored 'General case' 0 C--O 1.232 0.141 0 C-N-CA 125.471 1.508 . . . . 0.0 110.639 -177.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 42.5 t-105 -68.08 -50.97 51.67 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.989 0.916 . . . . 0.0 110.242 166.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -58.76 -38.9 79.48 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 118.723 0.692 . . . . 0.0 110.115 -177.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.422 ' HD2' ' HA ' ' A' ' 33' ' ' ASP . 63.6 mtt180 . . . . . 0 N--CA 1.471 0.583 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 177.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 92.8 mt . . . . . 0 N--CA 1.448 -0.538 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -122.07 156.39 33.67 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.752 1.221 . . . . 0.0 109.265 -167.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.477 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 14.8 m-85 -68.59 96.18 0.69 Allowed 'General case' 0 C--O 1.233 0.236 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 174.298 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 131.31 7.61 3.13 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 124.153 0.883 . . . . 0.0 113.516 -176.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.43 -20.56 55.98 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 116.142 1.905 . . . . 0.0 116.142 -168.39 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.565 ' H ' HG23 ' A' ' 60' ' ' VAL . 11.0 ttmt 44.59 128.54 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 130.784 3.634 . . . . 0.0 118.572 171.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.449 HD22 ' HB1' ' A' ' 15' ' ' ALA . 5.3 mt -127.86 151.98 48.39 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 124.605 1.162 . . . . 0.0 109.079 178.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 81.6 t -127.03 142.11 44.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 N-CA-C 104.959 -2.237 . . . . 0.0 104.959 163.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 14.3 p-10 -107.56 176.51 5.13 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 124.736 1.214 . . . . 0.0 110.872 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.23 -11.31 30.01 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.103 0.961 . . . . 0.0 112.846 -179.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -99.83 6.05 45.4 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.475 1.51 . . . . 0.0 110.37 179.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 66.25 18.32 10.9 Favored 'General case' 0 C--N 1.344 0.36 0 C-N-CA 127.158 2.183 . . . . 0.0 112.075 -178.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 22.5 m170 -75.31 117.28 16.95 Favored 'General case' 0 N--CA 1.443 -0.803 0 O-C-N 120.99 -1.069 . . . . 0.0 108.892 175.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 57.1 m -75.49 138.02 41.3 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 169.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -143.5 158.0 44.0 Favored 'General case' 0 C--N 1.334 -0.105 0 C-N-CA 126.244 1.817 . . . . 0.0 111.071 177.442 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.565 HG23 ' H ' ' A' ' 50' ' ' LYS . 4.1 p -152.45 151.21 12.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 168.097 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 34.3 tp -69.38 132.7 46.8 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 127.176 2.19 . . . . 0.0 109.41 173.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -113.51 174.98 5.65 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.973 1.309 . . . . 0.0 109.399 178.053 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.477 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 28.4 mt-10 -64.31 -20.49 66.12 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 125.715 1.606 . . . . 0.0 113.146 -177.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -82.0 6.08 17.23 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.416 1.487 . . . . 0.0 111.612 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 68.03 -4.52 1.01 Allowed 'General case' 0 C--O 1.237 0.404 0 C-N-CA 128.874 2.87 . . . . 0.0 113.931 -175.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -77.49 168.3 20.23 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 119.378 0.99 . . . . 0.0 111.959 172.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.447 ' CZ3' ' HA ' ' A' ' 60' ' ' VAL . 22.2 m95 -107.99 144.02 35.86 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 107.407 -1.331 . . . . 0.0 107.407 166.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -134.22 151.73 76.96 Favored Pre-proline 0 C--N 1.331 -0.235 0 C-N-CA 124.557 1.143 . . . . 0.0 111.626 -167.729 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -74.71 146.95 34.62 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 124.026 3.151 . . . . 0.0 112.607 -172.398 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -135.07 36.49 3.03 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.205 1.402 . . . . 0.0 111.927 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 70.99 166.4 0.13 Allowed Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 126.519 1.928 . . . . 0.0 111.896 -177.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.02 176.38 9.99 Favored 'Trans proline' 0 CA--C 1.535 0.543 0 C-N-CA 121.386 1.39 . . . . 0.0 111.269 170.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 14.5 tp -120.77 151.35 54.41 Favored Pre-proline 0 CA--C 1.543 0.675 0 C-N-CA 125.17 1.388 . . . . 0.0 110.234 -176.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -73.27 163.16 38.66 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.837 2.358 . . . . 0.0 111.171 168.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.0 -25.17 23.17 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 122.423 2.082 . . . . 0.0 112.879 179.104 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -83.36 -19.03 36.86 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 119.132 0.878 . . . . 0.0 110.636 176.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.69 -18.2 51.7 Favored Glycine 0 CA--C 1.532 1.111 0 N-CA-C 111.269 -0.733 . . . . 0.0 111.269 171.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 40.3 tp -60.0 -54.06 50.47 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 124.836 1.254 . . . . 0.0 108.429 170.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -62.73 -24.64 67.78 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 125.501 1.521 . . . . 0.0 112.239 179.556 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 -66.91 -45.4 78.06 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 120.393 1.451 . . . . 0.0 109.874 172.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -67.62 -54.98 15.18 Favored 'General case' 0 C--O 1.231 0.111 0 N-CA-C 108.218 -1.031 . . . . 0.0 108.218 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 12.2 mm -55.7 -32.22 30.95 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 125.165 1.386 . . . . 0.0 110.961 -178.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.81 -57.04 4.63 Favored 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 124.259 1.023 . . . . 0.0 111.447 175.325 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -70.5 -34.87 72.82 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 120.341 -0.543 . . . . 0.0 111.58 -170.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 28.5 t60 -60.67 -53.16 60.85 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.661 0.784 . . . . 0.0 109.852 175.442 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 99.6 m -63.8 -37.91 89.15 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 118.296 -0.859 . . . . 0.0 110.484 179.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.06 -36.49 77.73 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 119.242 0.928 . . . . 0.0 112.402 -179.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 13.1 t -70.06 -32.82 71.11 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.886 0.766 . . . . 0.0 110.479 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 63.8 mt -80.03 -56.59 4.14 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.721 0.808 . . . . 0.0 109.682 177.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 135.19 7.83 1.91 Allowed Glycine 0 CA--C 1.539 1.548 0 C-N-CA 126.004 1.764 . . . . 0.0 114.055 -175.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 39.3 m-70 . . . . . 0 C--O 1.237 0.401 0 CA-C-N 119.956 1.878 . . . . 0.0 110.488 -179.872 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 58.8 m80 . . . . . 0 CA--C 1.54 0.584 0 N-CA-C 112.84 0.681 . . . . 0.0 112.84 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 43.1 mt -148.07 128.89 14.31 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 127.567 2.347 . . . . 0.0 106.309 -160.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -66.57 -46.24 76.68 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.924 0.393 . . . . 0.0 110.331 -176.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 74.3 m -153.72 174.04 15.05 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.264 1.426 . . . . 0.0 110.292 -171.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 38.8 t -50.41 -39.74 17.52 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 C-N-CA 126.799 2.04 . . . . 0.0 109.496 173.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 20.9 tpp -57.1 -40.03 76.22 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 124.186 0.994 . . . . 0.0 113.386 177.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -69.89 -42.1 73.86 Favored 'General case' 0 N--CA 1.463 0.177 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 177.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.74 -45.6 91.97 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.785 1.234 . . . . 0.0 112.381 -172.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 11.0 mm -58.05 -43.9 86.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -66.85 -46.43 75.1 Favored 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 124.154 0.981 . . . . 0.0 110.411 -178.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 36.1 t80 -53.71 -61.48 2.27 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 125.516 1.526 . . . . 0.0 110.063 177.391 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 7.2 mp -50.34 -46.76 55.92 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.154 1.382 . . . . 0.0 112.384 175.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -63.0 -36.77 84.66 Favored 'General case' 0 C--N 1.333 -0.142 0 O-C-N 123.323 0.39 . . . . 0.0 111.591 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -74.86 -26.13 59.46 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 118.542 -0.742 . . . . 0.0 111.584 179.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 29.2 mt . . . . . 0 N--CA 1.465 0.278 0 C-N-CA 124.043 0.937 . . . . 0.0 109.358 -177.331 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.446 -0.627 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.24 -55.04 0.07 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.207 0 C-N-CA 121.756 1.637 . . . . 0.0 110.883 177.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 19.0 t-80 -150.56 147.41 21.36 Favored Pre-proline 0 CA--C 1.534 0.338 0 C-N-CA 125.732 1.613 . . . . 0.0 107.708 -178.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -69.11 -38.62 8.94 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 122.795 2.33 . . . . 0.0 111.885 176.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.29 -17.58 61.86 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 117.901 -1.047 . . . . 0.0 112.255 -176.167 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.9 tt -58.74 122.6 13.93 Favored 'General case' 0 C--N 1.346 0.425 0 CA-C-N 118.692 0.678 . . . . 0.0 109.315 170.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.434 ' CG1' HD21 ' A' ' 55' ' ' ASN . 43.6 mm -109.95 117.43 54.66 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.257 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 176.28 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -55.17 152.51 14.88 Favored Pre-proline 0 CA--C 1.534 0.335 0 C-N-CA 123.841 0.856 . . . . 0.0 111.114 174.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -73.38 174.27 51.24 Favored 'Cis proline' 0 CA--C 1.535 0.541 0 C-N-CA 125.204 -0.749 . . . . 0.0 112.792 -0.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -138.55 173.06 11.99 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 121.234 0.54 . . . . 0.0 111.887 177.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.423 HD22 HD12 ' A' ' 25' ' ' LEU . 18.8 mt -139.78 110.38 6.71 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 126.014 1.725 . . . . 0.0 109.301 -175.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.8 tp -87.2 150.81 23.68 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.365 1.066 . . . . 0.0 108.303 167.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.13 84.84 2.06 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 119.895 1.225 . . . . 0.0 108.621 170.241 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.465 ' NE2' HE21 ' A' ' 46' ' ' GLN . 0.1 OUTLIER -52.41 134.15 34.63 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 122.815 0.446 . . . . 0.0 111.273 -168.84 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -64.27 125.94 26.18 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.13 -0.941 . . . . 0.0 108.909 -168.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 98.29 -19.99 52.29 Favored Glycine 0 CA--C 1.527 0.815 0 CA-C-O 118.241 -1.311 . . . . 0.0 112.168 -178.405 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 2.3 t -88.85 -177.09 5.42 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 119.423 1.612 . . . . 0.0 109.989 174.263 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.1 m-80 -127.66 -12.66 5.44 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 124.644 1.178 . . . . 0.0 110.105 170.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -76.13 126.73 31.53 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 -176.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.511 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 3.5 mm? -75.51 147.32 39.85 Favored 'General case' 0 CA--C 1.52 -0.207 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 168.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -108.6 87.26 4.17 Favored Pre-proline 0 CA--C 1.537 0.453 0 C-N-CA 126.309 1.844 . . . . 0.0 109.081 175.057 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -66.32 113.09 2.53 Favored 'Trans proline' 0 N--CA 1.46 -0.496 0 C-N-CA 123.499 2.799 . . . . 0.0 109.901 177.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.2 mt -112.18 107.84 16.87 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 -177.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -51.65 -47.77 63.62 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 126.478 1.911 . . . . 0.0 111.587 -176.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.3 t -163.91 -179.25 6.16 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-O 121.949 0.88 . . . . 0.0 108.721 -168.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -68.33 -21.94 64.72 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 115.106 -0.952 . . . . 0.0 112.387 -175.384 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -69.85 -35.39 74.69 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 123.631 0.772 . . . . 0.0 110.626 169.224 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.8 t0 -67.03 -41.32 86.81 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 123.661 0.784 . . . . 0.0 109.423 177.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 75.5 t-105 -54.01 -41.06 67.57 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 121.536 -0.727 . . . . 0.0 111.193 172.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -71.91 -37.13 70.13 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 118.466 -0.778 . . . . 0.0 111.574 176.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.221 -0.436 0 CA-C-N 119.485 1.039 . . . . 0.0 109.972 172.483 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.1 mt . . . . . 0 C--O 1.235 0.314 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.465 HE21 ' NE2' ' A' ' 19' ' ' GLN . 21.8 pt20 -140.33 163.06 33.79 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.315 1.046 . . . . 0.0 110.987 -174.759 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -76.19 70.92 2.88 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.622 1.169 . . . . 0.0 110.959 -171.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 152.03 18.18 0.06 OUTLIER Glycine 0 CA--C 1.524 0.6 0 CA-C-O 118.908 -0.94 . . . . 0.0 114.433 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -71.22 -17.04 62.53 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.305 1.442 . . . . 0.0 113.437 179.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 52.25 154.91 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 129.869 3.267 . . . . 0.0 113.454 -174.302 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.7 tp -136.73 151.62 49.43 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 106.156 -1.794 . . . . 0.0 106.156 169.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 39.8 t -134.46 141.03 44.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 105.359 -2.089 . . . . 0.0 105.359 163.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -106.15 -178.67 3.72 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.077 1.351 . . . . 0.0 111.422 176.354 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.3 t -58.75 -24.39 61.55 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.271 1.428 . . . . 0.0 112.62 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.434 HD21 ' CG1' ' A' ' 12' ' ' ILE . 47.5 m-80 -90.23 1.04 56.9 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 124.498 1.119 . . . . 0.0 111.618 -179.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 65.93 24.05 11.22 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.519 1.128 . . . . 0.0 111.254 -173.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 24.3 m170 -69.11 108.52 3.61 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 164.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 92.8 m -70.81 153.35 42.83 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 121.702 0.763 . . . . 0.0 109.055 164.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -142.86 156.33 44.91 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.334 1.454 . . . . 0.0 108.157 170.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 25.7 t -135.19 144.69 33.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 C-N-CA 125.667 1.587 . . . . 0.0 107.78 166.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 11.9 tp -75.29 129.76 37.95 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 128.859 2.864 . . . . 0.0 106.872 175.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -120.91 170.55 9.38 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -178.197 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -61.09 -23.52 65.55 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 123.762 0.825 . . . . 0.0 112.161 -175.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -74.97 4.14 7.11 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.613 1.565 . . . . 0.0 112.341 176.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 58.56 21.77 9.01 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 128.419 2.687 . . . . 0.0 113.517 175.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -101.65 170.54 8.11 Favored 'General case' 0 C--O 1.232 0.17 0 C-N-CA 123.971 0.908 . . . . 0.0 110.259 163.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 62.2 m95 -103.16 95.47 6.14 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 171.058 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 60.5 t60 -69.13 144.51 95.38 Favored Pre-proline 0 CA--C 1.54 0.572 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 178.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -69.82 106.48 1.68 Allowed 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 123.788 2.992 . . . . 0.0 111.386 178.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -81.51 37.28 0.45 Allowed 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.59 1.556 . . . . 0.0 111.895 -177.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 69.79 165.05 0.13 Allowed Pre-proline 0 CA--C 1.541 0.611 0 C-N-CA 128.364 2.666 . . . . 0.0 112.751 -173.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -74.44 168.23 25.3 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 121.336 1.357 . . . . 0.0 110.06 166.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 21.6 tp -121.33 144.3 39.6 Favored Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 124.622 1.169 . . . . 0.0 108.817 -176.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.89 167.48 27.11 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.708 2.272 . . . . 0.0 110.76 172.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -66.46 -35.09 31.78 Favored 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 120.791 0.994 . . . . 0.0 111.491 -175.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -67.48 -27.11 66.74 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.886 1.274 . . . . 0.0 110.731 174.119 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -69.49 -29.61 71.5 Favored Glycine 0 N--CA 1.444 -0.788 0 CA-C-O 119.351 -0.694 . . . . 0.0 111.655 -173.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 21.1 tp -51.52 -47.42 63.33 Favored 'General case' 0 C--N 1.342 0.251 0 CA-C-N 117.683 0.741 . . . . 0.0 110.158 170.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -58.62 -30.64 67.42 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-O 117.259 -1.353 . . . . 0.0 111.384 -173.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 60.8 m-20 -57.68 -37.06 72.8 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 120.302 1.41 . . . . 0.0 111.279 176.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -71.42 -62.14 1.52 Allowed 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 -178.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.429 HD12 HD11 ' A' ' 109' ' ' LEU . 15.9 mm -59.47 -28.12 38.99 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 122.991 0.517 . . . . 0.0 111.671 -174.25 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.5 mtm180 -48.65 -40.59 28.44 Favored 'General case' 0 C--N 1.338 0.096 0 C-N-CA 124.924 1.29 . . . . 0.0 111.619 171.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.48 -61.41 2.46 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.446 1.098 . . . . 0.0 110.441 177.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.511 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 7.9 t60 -52.32 -43.89 64.8 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 125.514 1.526 . . . . 0.0 110.015 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 93.8 m -68.48 -43.62 76.56 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 121.588 -0.695 . . . . 0.0 111.86 179.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.11 -39.18 92.74 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 118.812 0.733 . . . . 0.0 111.246 -174.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 12.4 t -69.33 -11.74 61.07 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 118.189 -0.91 . . . . 0.0 111.791 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 67.2 mt -125.78 -4.44 7.03 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.71 1.604 . . . . 0.0 113.231 -176.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 73.75 20.91 79.8 Favored Glycine 0 CA--C 1.536 1.402 0 O-C-N 120.403 -1.436 . . . . 0.0 114.501 -178.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . 0.514 ' NE2' HD13 ' A' ' 112' ' ' LEU . 10.1 m-70 . . . . . 0 C--O 1.243 0.719 0 CA-C-N 119.951 1.876 . . . . 0.0 112.476 -172.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 . . . . . 0 CA--C 1.539 0.525 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -111.24 115.25 29.03 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 126.583 1.953 . . . . 0.0 109.388 172.514 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 10.7 t-160 -58.65 -28.99 66.21 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 172.314 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 18.6 m -148.86 165.15 32.37 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.458 -0.776 . . . . 0.0 110.229 -172.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 40.6 t -63.11 -35.72 72.94 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 O-C-N 121.65 -0.657 . . . . 0.0 109.873 179.314 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -40.65 88.54 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 126.495 1.918 . . . . 0.0 111.233 175.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.59 -51.02 71.19 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 178.655 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.12 -50.91 71.82 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.057 1.343 . . . . 0.0 112.794 -176.742 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 33.9 mm -55.87 -47.92 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 CA-C-N 119.938 1.245 . . . . 0.0 109.041 -175.358 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -69.66 -40.76 76.24 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 123.954 0.902 . . . . 0.0 110.105 -172.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.69 ' CE2' HD11 ' A' ' 112' ' ' LEU . 73.8 t80 -52.17 -67.08 0.28 Allowed 'General case' 0 C--O 1.224 -0.237 0 C-N-CA 125.224 1.41 . . . . 0.0 109.633 171.606 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.666 ' HA ' HD12 ' A' ' 112' ' ' LEU . 7.7 mp -45.45 -45.97 13.26 Favored 'General case' 0 C--N 1.345 0.383 0 C-N-CA 124.498 1.119 . . . . 0.0 112.08 175.027 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -62.64 -39.92 95.38 Favored 'General case' 0 C--N 1.334 -0.079 0 CA-C-O 119.207 -0.425 . . . . 0.0 112.031 -178.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -85.7 -11.25 54.18 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 118.531 0.605 . . . . 0.0 112.497 -176.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.69 HD11 ' CE2' ' A' ' 108' ' ' PHE . 45.4 mt . . . . . 0 CA--C 1.517 -0.302 0 CA-C-N 118.932 0.787 . . . . 0.0 110.082 173.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.542 0.651 0 N-CA-C 111.558 0.207 . . . . 0.0 111.558 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -83.6 80.3 2.54 Favored 'Trans proline' 0 N--CA 1.448 -1.179 0 C-N-CA 122.837 2.358 . . . . 0.0 109.204 -175.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 75.33 149.69 0.13 Allowed Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 127.12 2.168 . . . . 0.0 110.917 -176.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -93.26 -18.77 0.56 Allowed 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 122.751 2.3 . . . . 0.0 112.572 174.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.83 -18.58 65.45 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 119.162 0.892 . . . . 0.0 110.37 169.725 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 tt -67.58 132.01 46.73 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.321 0.648 . . . . 0.0 110.683 169.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 40.1 mm -120.87 99.97 8.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 C-N-CA 126.822 2.049 . . . . 0.0 108.398 -174.576 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -50.06 151.16 3.63 Favored Pre-proline 0 C--O 1.235 0.335 0 C-N-CA 124.059 0.944 . . . . 0.0 112.621 179.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -70.48 165.49 78.56 Favored 'Cis proline' 0 CA--C 1.532 0.387 0 O-C-N 122.982 0.99 . . . . 0.0 112.754 1.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.463 ' HB1' HD12 ' A' ' 51' ' ' LEU . . . -140.11 172.11 13.23 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.328 0.585 . . . . 0.0 111.809 176.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 14.7 mt -140.36 105.83 5.08 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 127.072 2.149 . . . . 0.0 107.498 -171.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 25.9 tp -77.72 152.85 33.47 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 167.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.19 84.75 1.71 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.959 1.254 . . . . 0.0 113.426 176.343 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -44.89 144.59 1.14 Allowed 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 116.012 1.856 . . . . 0.0 116.012 -166.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -76.67 85.63 3.32 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 124.981 1.312 . . . . 0.0 109.681 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 138.21 -34.85 2.09 Favored Glycine 0 CA--C 1.524 0.643 0 C-N-CA 126.426 1.965 . . . . 0.0 110.988 175.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -83.38 -20.68 33.78 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 118.371 -0.823 . . . . 0.0 113.092 -163.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 12.8 m-80 71.64 -21.43 0.21 Allowed 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 126.811 2.044 . . . . 0.0 112.511 -179.124 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -65.47 150.38 48.45 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 125.791 1.636 . . . . 0.0 111.56 173.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.2 mt -107.22 153.47 22.64 Favored 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 126.141 1.776 . . . . 0.0 109.013 171.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -118.57 86.87 30.07 Favored Pre-proline 0 CA--C 1.537 0.447 0 C-N-CA 124.992 1.317 . . . . 0.0 109.557 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -65.08 128.18 20.06 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 123.483 2.788 . . . . 0.0 110.338 178.126 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.2 mt -134.36 113.93 12.42 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 -177.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 4.1 mtt85 -64.64 -46.71 81.38 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.849 0.86 . . . . 0.0 112.419 -169.351 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.551 ' H ' ' HB2' ' A' ' 33' ' ' ASP . 43.1 p -141.48 -179.92 6.43 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.931 1.293 . . . . 0.0 109.738 -178.432 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -53.62 -36.36 61.92 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 123.705 0.802 . . . . 0.0 110.752 167.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -65.98 -30.22 70.74 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 123.241 0.616 . . . . 0.0 110.84 -179.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.551 ' HB2' ' H ' ' A' ' 30' ' ' THR . 0.3 OUTLIER -70.79 -41.22 71.93 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 123.621 0.769 . . . . 0.0 109.892 174.961 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 67.6 t-105 -60.72 -42.82 98.03 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 110.5 -0.185 . . . . 0.0 110.5 173.44 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -59.42 -38.37 80.47 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 121.175 -0.953 . . . . 0.0 110.982 174.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.227 -0.098 0 C-N-CA 125.599 1.56 . . . . 0.0 112.826 176.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 19.9 mt . . . . . 0 C--O 1.234 0.27 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -108.85 149.1 29.6 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 126.482 1.913 . . . . 0.0 108.048 -179.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.657 ' HA ' HD13 ' A' ' 61' ' ' LEU . 57.9 m-85 -71.73 153.51 41.96 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 176.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.15 16.95 73.48 Favored Glycine 0 CA--C 1.531 1.067 0 CA-C-O 119.509 -0.606 . . . . 0.0 114.087 -173.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -59.65 -25.46 64.72 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.09 1.445 . . . . 0.0 113.283 175.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.7 ttmt 69.75 142.29 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 127.759 2.423 . . . . 0.0 111.006 -175.218 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.463 HD12 ' HB1' ' A' ' 15' ' ' ALA . 0.2 OUTLIER -123.68 146.81 47.96 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 105.497 -2.038 . . . . 0.0 105.497 165.348 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 72.5 t -135.28 143.71 36.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 106.343 -1.725 . . . . 0.0 106.343 170.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -125.3 -179.13 4.46 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.03 1.732 . . . . 0.0 111.627 -177.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.41 -19.49 65.96 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.977 1.102 . . . . 0.0 113.977 179.109 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -85.69 0.18 53.45 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 118.869 0.759 . . . . 0.0 111.065 175.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 54.78 31.7 16.07 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 126.16 1.784 . . . . 0.0 110.107 -168.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 29.6 m170 -71.23 115.21 10.11 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 120.248 -1.533 . . . . 0.0 107.151 166.276 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.2 m -77.03 147.51 36.72 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 167.186 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -135.92 159.7 40.87 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 125.014 1.325 . . . . 0.0 108.125 169.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 27.2 t -137.84 135.13 45.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 C-N-CA 129.061 2.944 . . . . 0.0 106.333 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.657 HD13 ' HA ' ' A' ' 47' ' ' TYR . 0.4 OUTLIER -78.27 140.02 38.87 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 175.127 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -113.49 161.16 17.69 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 123.259 0.624 . . . . 0.0 109.824 175.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.408 ' HA ' ' CZ ' ' A' ' 47' ' ' TYR . 2.8 mt-10 -53.15 -25.61 14.03 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.655 0.782 . . . . 0.0 112.528 -177.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.83 -12.15 2.87 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 129.404 3.082 . . . . 0.0 114.041 172.192 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 63.69 36.73 10.55 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-N 120.423 1.465 . . . . 0.0 110.851 -174.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -124.3 173.57 8.29 Favored 'General case' 0 N--CA 1.457 -0.099 0 C-N-CA 125.072 1.349 . . . . 0.0 111.161 164.375 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 70.7 m95 -115.89 121.28 41.86 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 125.074 1.35 . . . . 0.0 107.87 177.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -95.34 155.79 38.39 Favored Pre-proline 0 N--CA 1.439 -0.981 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 179.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -66.53 121.36 8.6 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 123.084 2.523 . . . . 0.0 109.094 170.64 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -108.23 40.53 1.74 Allowed 'General case' 0 C--O 1.236 0.35 0 C-N-CA 124.747 1.219 . . . . 0.0 109.987 -177.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.85 165.91 0.13 Allowed Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 127.136 2.174 . . . . 0.0 112.682 179.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -71.79 178.0 6.3 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 121.567 1.511 . . . . 0.0 111.007 166.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 15.7 tp -142.65 145.06 32.6 Favored Pre-proline 0 CA--C 1.535 0.369 0 C-N-CA 124.083 0.953 . . . . 0.0 111.648 -169.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -67.81 165.88 26.29 Favored 'Trans proline' 0 CA--C 1.536 0.617 0 C-N-CA 122.619 2.213 . . . . 0.0 113.039 176.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -61.77 -22.5 74.51 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 123.688 2.925 . . . . 0.0 113.257 173.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -86.36 -16.37 37.59 Favored 'General case' 0 C--N 1.332 -0.179 0 O-C-N 121.304 -0.872 . . . . 0.0 112.25 176.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -67.55 -32.89 79.78 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 120.537 -0.839 . . . . 0.0 111.958 179.326 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 35.8 tp -53.97 -58.62 6.63 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 118.054 0.927 . . . . 0.0 108.581 168.227 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -46.14 -37.69 7.27 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 126.52 1.928 . . . . 0.0 113.502 178.717 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -70.86 -37.21 73.08 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 124.583 1.153 . . . . 0.0 112.005 -177.518 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.2 tp -70.37 -51.45 29.72 Favored 'General case' 0 CA--C 1.521 -0.15 0 C-N-CA 124.866 1.266 . . . . 0.0 110.964 175.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 27.6 mm -57.47 -35.54 50.07 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 -177.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -46.22 -39.22 9.48 Favored 'General case' 0 C--O 1.224 -0.253 0 C-N-CA 124.798 1.239 . . . . 0.0 112.988 173.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.97 -62.27 1.98 Allowed 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 123.718 0.807 . . . . 0.0 109.599 178.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 42.8 t60 -57.7 -39.14 76.52 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.151 0.98 . . . . 0.0 110.723 -177.463 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 66.0 m -64.88 -41.12 95.89 Favored 'General case' 0 N--CA 1.448 -0.527 0 O-C-N 121.438 -0.789 . . . . 0.0 111.788 176.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.33 -38.27 81.37 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 124.493 1.117 . . . . 0.0 112.302 179.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.2 t -64.44 -40.56 95.98 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 118.895 0.77 . . . . 0.0 109.809 178.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 85.2 mt -82.11 -72.35 0.44 Allowed 'General case' 0 C--O 1.233 0.227 0 C-N-CA 123.819 0.848 . . . . 0.0 108.789 -176.108 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 143.61 42.19 0.06 OUTLIER Glycine 0 CA--C 1.525 0.7 0 C-N-CA 124.761 1.172 . . . . 0.0 111.212 -177.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 70.8 m-70 . . . . . 0 C--O 1.234 0.248 0 C-N-CA 124.136 0.974 . . . . 0.0 111.347 -174.948 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.536 0.412 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.634 HD13 ' HB2' ' A' ' 105' ' ' ALA . 97.1 mt -149.41 153.25 37.07 Favored 'General case' 0 CA--C 1.511 -0.522 0 C-N-CA 126.476 1.91 . . . . 0.0 109.279 -174.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 26.2 t-80 -76.32 -47.09 24.77 Favored 'General case' 0 N--CA 1.444 -0.728 0 C-N-CA 124.407 1.083 . . . . 0.0 112.018 167.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 53.9 m -170.14 179.11 3.62 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 125.461 1.504 . . . . 0.0 111.154 -171.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 63.8 t -66.47 -42.97 91.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 CA-C-N 119.602 1.092 . . . . 0.0 111.089 -174.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 4.4 tpt -56.83 -46.77 81.48 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 118.714 0.688 . . . . 0.0 109.405 -179.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -58.53 -36.84 74.48 Favored 'General case' 0 C--N 1.339 0.147 0 C-N-CA 124.143 0.977 . . . . 0.0 110.194 177.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.634 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -64.62 -45.73 85.63 Favored 'General case' 0 C--O 1.227 -0.131 0 C-N-CA 123.418 0.687 . . . . 0.0 111.929 178.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 30.1 mm -59.03 -47.78 88.82 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 -177.019 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -75.82 -32.04 59.65 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 118.834 -0.603 . . . . 0.0 111.31 -177.328 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -60.18 -56.4 22.02 Favored 'General case' 0 C--N 1.342 0.25 0 C-N-CA 123.922 0.889 . . . . 0.0 110.202 173.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 25.3 mt -57.6 -43.25 84.55 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -175.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -68.86 -7.69 36.87 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 175.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -107.03 -7.95 16.74 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 119.817 1.19 . . . . 0.0 112.601 176.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . 0.293 1.3 tp . . . . . 0 N--CA 1.416 -2.151 0 C-N-CA 126.472 1.909 . . . . 0.0 109.063 -177.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 6.8 p . . . . . 0 C--O 1.239 0.518 0 N-CA-C 110.572 -0.158 . . . . 0.0 110.572 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -68.18 -55.37 0.25 Allowed 'Trans proline' 0 N--CA 1.45 -1.081 0 C-N-CA 121.699 1.599 . . . . 0.0 110.842 169.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -140.45 153.88 68.91 Favored Pre-proline 0 CA--C 1.542 0.65 0 C-N-CA 126.949 2.1 . . . . 0.0 108.481 177.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -85.25 -17.94 4.32 Favored 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 122.75 2.3 . . . . 0.0 113.513 173.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -78.82 -17.61 55.41 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 118.905 0.775 . . . . 0.0 112.278 -179.054 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.405 HD12 ' HB3' ' A' ' 53' ' ' ASP . 0.6 OUTLIER -66.99 135.22 53.42 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.455 0.702 . . . . 0.0 111.013 165.224 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 47.9 mm -123.07 108.02 20.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 C-N-CA 127.27 2.228 . . . . 0.0 106.892 176.483 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 56.6 m95 -52.6 151.99 7.19 Favored Pre-proline 0 C--O 1.238 0.473 0 C-N-CA 124.68 1.192 . . . . 0.0 111.644 -179.215 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -69.69 169.44 63.06 Favored 'Cis proline' 0 N--CA 1.457 -0.658 0 N-CA-C 115.411 1.274 . . . . 0.0 115.411 -0.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.78 171.23 14.71 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.596 1.159 . . . . 0.0 111.392 -175.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -146.53 102.78 3.61 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.514 1.125 . . . . 0.0 111.04 -165.303 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.9 tp -78.32 150.32 33.3 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 123.35 0.66 . . . . 0.0 109.23 177.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.401 ' O ' ' HE2' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -150.7 84.98 1.36 Allowed 'General case' 0 C--O 1.237 0.416 0 CA-C-N 119.082 0.855 . . . . 0.0 110.574 174.404 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -59.76 158.59 10.11 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 123.565 0.746 . . . . 0.0 110.762 -167.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -67.22 125.33 25.72 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 122.836 1.303 . . . . 0.0 111.135 178.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 85.75 -31.96 3.82 Favored Glycine 0 CA--C 1.528 0.871 0 C-N-CA 125.692 1.615 . . . . 0.0 111.904 178.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 39.4 m -68.14 169.19 10.7 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 118.448 1.124 . . . . 0.0 110.077 170.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -141.1 -16.4 0.85 Allowed 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 125.265 1.426 . . . . 0.0 111.958 -175.021 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -71.03 105.94 3.51 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 175.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.474 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 3.9 mm? -60.37 137.86 58.07 Favored 'General case' 0 N--CA 1.462 0.162 0 N-CA-C 106.903 -1.518 . . . . 0.0 106.903 171.498 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.56 88.12 8.9 Favored Pre-proline 0 C--N 1.33 -0.261 0 C-N-CA 125.308 1.443 . . . . 0.0 107.864 -174.648 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -62.54 132.06 36.39 Favored 'Trans proline' 0 CA--C 1.541 0.829 0 C-N-CA 123.208 2.605 . . . . 0.0 109.994 176.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -119.4 118.05 30.13 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 106.105 -1.813 . . . . 0.0 106.105 168.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 72.7 mtm180 -75.03 -47.02 31.11 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 -174.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 67.4 p -135.59 178.59 6.92 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.815 0.846 . . . . 0.0 110.903 -179.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -60.03 -39.5 86.12 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.452 -0.78 . . . . 0.0 109.582 175.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -56.66 -23.81 44.17 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.459 1.104 . . . . 0.0 111.371 176.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -93.86 -32.51 13.9 Favored 'General case' 0 N--CA 1.454 -0.272 0 O-C-N 120.756 -1.215 . . . . 0.0 111.058 -172.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 11.0 t-105 -58.06 -42.83 86.3 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 165.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -53.53 -60.29 3.5 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 172.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.508 0 C-N-CA 117.556 -1.658 . . . . 0.0 110.204 -163.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 48.5 mt . . . . . 0 C--O 1.234 0.252 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -142.78 163.61 32.34 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 125.941 1.696 . . . . 0.0 107.54 -178.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.481 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 20.6 m-85 -55.95 138.23 49.2 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.77 0.795 . . . . 0.0 110.67 -179.108 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.28 7.69 76.15 Favored Glycine 0 CA--C 1.536 1.384 0 CA-C-O 118.096 -1.391 . . . . 0.0 114.244 179.181 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.97 -27.17 61.02 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 119.716 1.758 . . . . 0.0 115.483 -170.487 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.476 ' H ' HG23 ' A' ' 60' ' ' VAL . 22.0 ttmt 57.62 152.2 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 130.38 3.472 . . . . 0.0 115.791 174.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.4 tp -141.19 155.58 46.04 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 174.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 97.0 t -130.58 155.43 41.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 105.105 -2.183 . . . . 0.0 105.105 157.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.405 ' HB3' HD12 ' A' ' 11' ' ' LEU . 2.0 p-10 -123.5 -179.74 4.45 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 126.521 1.928 . . . . 0.0 111.76 176.512 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.5 m -68.55 -17.12 64.08 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 114.857 1.428 . . . . 0.0 114.857 177.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -77.36 -7.81 56.68 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 120.433 1.469 . . . . 0.0 111.27 168.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 64.66 32.28 11.44 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.885 1.274 . . . . 0.0 110.713 -167.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 54.1 m170 -83.61 110.3 18.13 Favored 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 166.398 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.5 m -79.67 149.18 31.33 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 169.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -146.64 164.81 31.49 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 125.448 1.499 . . . . 0.0 110.623 176.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.476 HG23 ' H ' ' A' ' 50' ' ' LYS . 7.6 p -153.72 150.89 11.97 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 CA-C-N 120.372 1.442 . . . . 0.0 113.871 170.028 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.433 HD12 ' O ' ' A' ' 66' ' ' HIS . 38.6 tp -72.19 135.62 46.17 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.744 2.017 . . . . 0.0 109.301 176.34 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -116.25 -179.74 3.76 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.313 1.045 . . . . 0.0 109.27 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.481 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 14.7 mp0 -60.32 -20.96 61.34 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.885 1.274 . . . . 0.0 113.826 -177.305 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -90.91 16.44 9.45 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.416 1.086 . . . . 0.0 112.552 -173.277 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 61.38 -0.57 0.36 Allowed 'General case' 0 C--O 1.239 0.547 0 C-N-CA 126.855 2.062 . . . . 0.0 114.075 -172.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.433 ' O ' HD12 ' A' ' 61' ' ' LEU . 0.9 OUTLIER -82.29 171.99 13.62 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 118.864 0.756 . . . . 0.0 111.164 176.379 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.416 ' CE2' ' HB2' ' A' ' 61' ' ' LEU . 26.2 m95 -115.57 147.14 41.07 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 168.748 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -134.55 162.87 55.13 Favored Pre-proline 0 CA--C 1.532 0.256 0 C-N-CA 125.272 1.429 . . . . 0.0 111.272 -169.013 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -72.19 133.15 20.68 Favored 'Trans proline' 0 CA--C 1.535 0.548 0 C-N-CA 123.5 2.8 . . . . 0.0 112.587 -176.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -114.46 29.52 7.96 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.999 1.32 . . . . 0.0 111.432 175.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 70.05 165.35 0.13 Allowed Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 127.615 2.366 . . . . 0.0 111.899 -178.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -70.43 173.01 12.2 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 121.207 1.271 . . . . 0.0 110.259 168.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 12.6 tp -127.19 144.29 50.09 Favored Pre-proline 0 CA--C 1.533 0.322 0 CA-C-O 117.755 -1.117 . . . . 0.0 108.569 -178.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -76.02 169.36 22.27 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 122.761 2.307 . . . . 0.0 110.19 173.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -63.02 -30.31 76.15 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 121.889 1.726 . . . . 0.0 112.918 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -82.1 -21.52 36.71 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 119.385 0.993 . . . . 0.0 111.459 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.22 -16.28 57.72 Favored Glycine 0 CA--C 1.534 1.247 0 O-C-N 121.872 -0.518 . . . . 0.0 112.457 178.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 23.8 tp -61.04 -52.55 64.51 Favored 'General case' 0 C--O 1.232 0.148 0 C-N-CA 126.133 1.773 . . . . 0.0 109.592 172.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -71.65 -34.13 69.49 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 125.306 1.442 . . . . 0.0 109.088 -169.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -52.57 -48.44 66.19 Favored 'General case' 0 CA--C 1.516 -0.333 0 C-N-CA 126.185 1.794 . . . . 0.0 112.081 172.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 28.9 mt -65.01 -58.2 6.72 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.416 177.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.486 HD12 HD11 ' A' ' 109' ' ' LEU . 16.4 mm -58.86 -25.0 27.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.339 0 CA-C-O 118.952 -0.546 . . . . 0.0 111.984 -175.579 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 5.7 ttm180 -46.32 -40.37 11.67 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-O 117.909 -1.043 . . . . 0.0 111.523 173.104 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -67.29 -45.85 75.32 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 119.385 0.993 . . . . 0.0 112.041 -178.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.474 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 10.9 t60 -61.96 -45.43 93.68 Favored 'General case' 0 C--O 1.223 -0.3 0 C-N-CA 124.473 1.109 . . . . 0.0 109.318 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 99.1 m -69.42 -46.11 67.59 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 121.548 -0.72 . . . . 0.0 110.657 -179.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.23 -44.72 95.91 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 118.392 -0.813 . . . . 0.0 110.861 -177.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 8.4 t -67.25 -17.86 64.97 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 117.986 -1.007 . . . . 0.0 112.181 -175.198 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 83.7 mt -110.64 -35.31 6.04 Favored 'General case' 0 C--N 1.341 0.222 0 CA-C-N 119.097 0.862 . . . . 0.0 111.524 -172.593 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 115.18 17.91 6.52 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.975 1.274 . . . . 0.0 113.293 -179.33 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . 0.71 ' CE1' HD13 ' A' ' 112' ' ' LEU . 20.6 m170 . . . . . 0 C--O 1.242 0.681 0 CA-C-N 118.404 1.102 . . . . 0.0 111.556 -173.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.533 0.318 0 N-CA-C 113.569 0.951 . . . . 0.0 113.569 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 18.4 mt -141.97 118.63 11.03 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 -161.064 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 13.0 t-160 -69.76 -43.08 72.97 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 118.323 0.51 . . . . 0.0 110.941 172.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 67.5 m -145.23 166.89 24.17 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 124.337 1.055 . . . . 0.0 110.199 -164.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 70.4 t -55.35 -35.7 37.86 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 169.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 2.8 tpt -52.76 -47.48 67.43 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 125.151 1.38 . . . . 0.0 112.024 175.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -59.06 -50.86 72.48 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.86 -48.83 78.76 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 125.112 1.365 . . . . 0.0 112.83 -172.445 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 19.9 mm -58.72 -45.1 91.2 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 -176.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -67.58 -43.0 81.63 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 122.725 0.41 . . . . 0.0 111.135 -178.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 44.6 t80 -50.18 -60.1 3.29 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.429 1.091 . . . . 0.0 110.246 176.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.486 HD11 HD12 ' A' ' 82' ' ' ILE . 9.0 mp -54.77 -45.79 74.31 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 125.04 1.336 . . . . 0.0 111.933 175.026 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -61.16 -31.57 71.3 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 119.606 -0.235 . . . . 0.0 111.515 -179.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -78.16 -18.58 55.38 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.923 0.889 . . . . 0.0 112.4 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.71 HD13 ' CE1' ' A' ' 91' ' ' HIS . 47.0 mt . . . . . 0 C--O 1.233 0.204 0 C-N-CA 124.955 1.302 . . . . 0.0 111.104 -177.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.474 0.747 0 CA-C-O 119.231 -0.414 . . . . 0.0 111.462 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.45 -47.43 0.18 Allowed 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.558 2.172 . . . . 0.0 111.595 177.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 16.4 t-80 -147.62 148.14 29.91 Favored Pre-proline 0 C--O 1.235 0.311 0 C-N-CA 126.882 2.073 . . . . 0.0 106.738 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -75.91 -32.95 4.05 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 121.318 1.345 . . . . 0.0 112.843 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -84.61 -4.43 58.99 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 117.872 -1.061 . . . . 0.0 112.713 179.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 tt -66.97 127.68 33.47 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 119.786 1.176 . . . . 0.0 108.09 165.03 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 24.1 mm -115.26 119.56 62.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 -177.156 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 75.7 m95 -63.66 152.91 85.12 Favored Pre-proline 0 CA--C 1.538 0.491 0 C-N-CA 123.441 0.696 . . . . 0.0 111.749 -177.021 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -74.36 168.89 75.57 Favored 'Cis proline' 0 CA--C 1.532 0.422 0 N-CA-C 113.376 0.491 . . . . 0.0 113.376 -0.155 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -126.97 166.88 16.7 Favored 'General case' 0 CA--C 1.521 -0.151 0 C-N-CA 124.024 0.929 . . . . 0.0 111.258 178.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 12.9 mt -143.26 102.37 3.96 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 126.186 1.795 . . . . 0.0 107.051 -178.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.9 tp -78.51 138.08 38.24 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 170.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.55 91.63 2.81 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 106.608 -1.626 . . . . 0.0 106.608 170.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -55.93 147.79 18.7 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 124.005 0.816 . . . . 0.0 111.974 -174.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -73.5 97.12 2.51 Favored 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 124.731 1.212 . . . . 0.0 110.345 -178.366 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 133.76 -49.43 0.91 Allowed Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 126.282 1.896 . . . . 0.0 108.978 -177.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 35.8 m -65.41 172.96 2.87 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 124.827 1.251 . . . . 0.0 111.076 -178.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 18.0 m-80 -129.29 -31.2 2.09 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 124.736 1.215 . . . . 0.0 109.302 175.376 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -67.27 95.71 0.44 Allowed 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 128.19 2.596 . . . . 0.0 108.963 -175.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.428 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 3.1 mm? -53.36 143.61 18.5 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.734 0.813 . . . . 0.0 109.819 178.537 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.402 ' HA ' ' HD2' ' A' ' 27' ' ' PRO . 1.4 tm? -111.97 87.42 8.65 Favored Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 125.705 1.602 . . . . 0.0 108.603 173.235 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.402 ' HD2' ' HA ' ' A' ' 26' ' ' LEU . 57.6 Cg_endo -62.55 136.81 60.78 Favored 'Trans proline' 0 CA--C 1.535 0.546 1 C-N-CA 125.712 4.275 . . . . 0.0 111.75 174.164 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -124.14 114.79 20.14 Favored 'General case' 0 N--CA 1.462 0.134 0 C-N-CA 125.961 1.704 . . . . 0.0 108.244 170.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.6 mmm180 -62.35 -56.21 20.61 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 126.057 1.743 . . . . 0.0 109.995 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 61.6 p -139.05 -178.21 5.24 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 124.353 1.061 . . . . 0.0 108.621 178.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -59.67 -29.54 68.14 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.505 -0.747 . . . . 0.0 111.885 167.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -61.67 -23.44 66.09 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.68 0.792 . . . . 0.0 111.168 175.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -84.45 -46.79 11.3 Favored 'General case' 0 C--O 1.223 -0.293 0 C-N-CA 126.335 1.854 . . . . 0.0 109.754 177.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 39.0 t-105 -55.48 -38.5 69.21 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 120.776 -1.203 . . . . 0.0 110.982 175.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 4.4 mm100 -61.34 -43.07 99.49 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.599 1.16 . . . . 0.0 111.85 172.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 69.5 mtt85 . . . . . 0 CA--C 1.518 -0.281 0 CA-C-O 118.572 -0.727 . . . . 0.0 110.988 176.514 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.8 mt . . . . . 0 C--O 1.24 0.563 0 N-CA-C 105.988 -1.856 . . . . 0.0 105.988 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -136.07 163.99 29.05 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 124.039 0.936 . . . . 0.0 111.591 -168.525 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.401 ' CZ ' ' HA ' ' A' ' 63' ' ' GLU . 3.0 m-85 -69.0 109.86 4.17 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 106.722 -1.584 . . . . 0.0 106.722 -172.051 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.526 ' HA2' HG13 ' A' ' 60' ' ' VAL . . . 116.18 -4.71 20.12 Favored Glycine 0 CA--C 1.528 0.879 0 CA-C-O 117.62 -1.655 . . . . 0.0 114.805 -178.177 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -68.99 -2.64 10.39 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-N 120.703 2.251 . . . . 0.0 116.164 -169.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 9.6 ttmt 51.45 119.0 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 131.56 3.944 . . . . 0.0 116.473 167.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 10.3 mt -106.78 149.27 27.51 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 107.81 -1.182 . . . . 0.0 107.81 165.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 55.4 t -131.31 148.08 32.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 104.556 -2.386 . . . . 0.0 104.556 167.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -127.79 175.3 8.43 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 131.471 3.908 . . . . 0.0 110.36 -169.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.0 p -58.71 -35.19 72.26 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.803 0.841 . . . . 0.0 112.896 -179.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 40.6 m-20 -83.02 -0.43 48.85 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.657 1.583 . . . . 0.0 113.49 -176.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 62.64 22.06 13.09 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 120.028 1.286 . . . . 0.0 111.38 -177.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 34.7 m170 -71.02 103.85 2.82 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 119.85 -1.781 . . . . 0.0 110.086 160.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.07 146.44 54.18 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 120.108 1.322 . . . . 0.0 107.682 171.113 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -134.3 149.25 50.88 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 124.629 1.172 . . . . 0.0 108.091 174.39 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.526 HG13 ' HA2' ' A' ' 48' ' ' GLY . 37.1 t -137.01 140.11 43.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 C-N-CA 126.798 2.039 . . . . 0.0 106.915 175.587 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 27.9 tp -72.0 138.95 48.33 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 125.738 1.615 . . . . 0.0 107.995 173.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -109.86 168.94 9.05 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 124.32 1.048 . . . . 0.0 110.292 178.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.401 ' HA ' ' CZ ' ' A' ' 47' ' ' TYR . 16.4 mp0 -60.27 -37.65 81.12 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.866 0.867 . . . . 0.0 110.571 178.357 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -73.48 10.66 0.97 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.95 1.3 . . . . 0.0 113.264 176.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 74.14 7.58 4.72 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 127.803 2.441 . . . . 0.0 114.532 164.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -92.17 168.3 11.45 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.55 1.14 . . . . 0.0 110.296 170.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 58.5 m95 -105.13 96.84 6.8 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 108.177 -1.045 . . . . 0.0 108.177 175.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 53.4 t-80 -69.88 144.39 93.2 Favored Pre-proline 0 CA--C 1.543 0.708 0 CA-C-N 118.013 0.369 . . . . 0.0 110.006 179.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -69.4 103.03 1.04 Allowed 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 124.49 3.46 . . . . 0.0 111.262 171.536 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -83.45 37.01 0.55 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.293 1.837 . . . . 0.0 112.395 -178.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 67.59 165.28 0.12 Allowed Pre-proline 0 CA--C 1.546 0.809 0 C-N-CA 128.002 2.521 . . . . 0.0 112.716 178.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -72.71 174.65 11.42 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 121.526 1.484 . . . . 0.0 113.176 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.6 tt -131.49 143.73 50.42 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 127.157 2.183 . . . . 0.0 108.406 -168.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -89.43 166.47 5.29 Favored 'Trans proline' 0 CA--C 1.538 0.725 0 C-N-CA 124.065 3.177 . . . . 0.0 112.396 -178.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -58.19 -19.58 42.59 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.898 2.399 . . . . 0.0 113.93 178.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -101.56 -17.41 16.4 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 124.127 0.971 . . . . 0.0 111.086 -177.025 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.53 -40.37 98.67 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.135 -1.186 . . . . 0.0 110.135 174.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 54.6 tp -60.83 -50.21 74.35 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 179.018 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -63.61 -19.64 65.02 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.638 1.175 . . . . 0.0 111.793 -177.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -77.43 -47.13 20.54 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 119.696 1.135 . . . . 0.0 110.793 170.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 29.4 mt -57.63 -54.46 46.58 Favored 'General case' 0 N--CA 1.466 0.367 0 O-C-N 121.807 -0.558 . . . . 0.0 110.305 174.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 20.2 mm -58.11 -33.1 45.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 C-N-CA 125.084 1.354 . . . . 0.0 110.443 -178.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.86 -33.73 37.63 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 119.081 0.855 . . . . 0.0 111.729 174.369 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.4 -54.43 40.43 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 119.159 0.89 . . . . 0.0 110.472 -177.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.442 ' HE2' HD12 ' A' ' 112' ' ' LEU . 8.6 t60 -64.15 -39.33 93.8 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.478 0.711 . . . . 0.0 109.941 179.072 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 80.6 m -70.2 -40.82 74.37 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 121.327 -0.858 . . . . 0.0 111.405 -178.015 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -75.92 -31.06 58.96 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 118.925 0.784 . . . . 0.0 111.884 -177.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.8 t -66.1 -40.67 90.95 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 176.2 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 98.0 mt -81.16 -70.7 0.51 Allowed 'General case' 0 C--N 1.341 0.238 0 CA-C-O 118.596 -0.716 . . . . 0.0 109.256 -176.294 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 153.2 39.63 0.02 OUTLIER Glycine 0 CA--C 1.53 0.989 0 CA-C-O 118.572 -1.127 . . . . 0.0 113.768 171.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.541 0.629 0 CA-C-N 118.938 1.369 . . . . 0.0 111.841 -172.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.548 0.874 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.638 HD13 ' HB2' ' A' ' 105' ' ' ALA . 81.3 mt -144.47 171.24 14.63 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 128.385 2.674 . . . . 0.0 110.126 -157.063 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 29.7 t-80 -106.48 -27.16 11.08 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 126.217 1.807 . . . . 0.0 112.156 176.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 3.0 m -172.86 172.79 3.96 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.139 1.376 . . . . 0.0 111.392 -172.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 34.7 t -66.56 -44.66 89.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 175.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 51.2 tpp -56.99 -40.11 75.95 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.398 -0.814 . . . . 0.0 111.506 178.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -69.11 -31.33 69.95 Favored 'General case' 0 C--O 1.233 0.195 0 O-C-N 122.17 -0.331 . . . . 0.0 110.85 179.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.638 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -64.24 -46.87 81.88 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.656 1.182 . . . . 0.0 110.043 173.042 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 42.4 mm -56.68 -37.45 52.9 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.215 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 176.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.46 -47.35 61.03 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 119.331 0.968 . . . . 0.0 111.399 177.176 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -54.41 -55.2 31.14 Favored 'General case' 0 N--CA 1.461 0.083 0 C-N-CA 125.563 1.545 . . . . 0.0 111.57 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 63.7 mt -62.72 -34.86 78.04 Favored 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 124.527 1.131 . . . . 0.0 110.721 -173.218 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -74.18 -44.22 54.28 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 124.293 1.037 . . . . 0.0 110.251 -176.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -64.88 2.5 0.7 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.608 1.563 . . . . 0.0 114.2 178.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.442 HD12 ' HE2' ' A' ' 85' ' ' HIS . 69.7 mt . . . . . 0 CA--C 1.529 0.143 0 C-N-CA 124.216 1.006 . . . . 0.0 112.1 169.179 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.238 0.47 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -67.72 -49.27 1.18 Allowed 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.685 2.257 . . . . 0.0 112.002 175.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 4.5 t-80 -158.77 144.88 12.41 Favored Pre-proline 0 CA--C 1.534 0.332 0 CA-C-O 117.645 -1.169 . . . . 0.0 110.81 -175.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -72.24 -20.58 24.43 Favored 'Trans proline' 0 CA--C 1.534 0.486 0 C-N-CA 123.157 2.571 . . . . 0.0 112.96 175.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -85.03 -9.4 58.05 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.282 -0.886 . . . . 0.0 111.9 176.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.3 tt -78.67 132.21 36.95 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 123.957 0.903 . . . . 0.0 109.713 170.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 24.1 mm -120.53 114.11 42.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 176.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -56.5 153.8 19.28 Favored Pre-proline 0 C--O 1.238 0.456 0 CA-C-O 118.874 -0.584 . . . . 0.0 111.642 178.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -68.56 172.16 45.33 Favored 'Cis proline' 0 CA--C 1.535 0.563 0 N-CA-C 114.195 0.806 . . . . 0.0 114.195 -1.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -136.2 171.63 14.19 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.521 0.728 . . . . 0.0 112.132 176.105 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 14.5 mt -143.38 108.32 4.93 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 127.555 2.342 . . . . 0.0 106.901 -177.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.6 tp -83.3 148.38 27.4 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 170.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.66 90.26 1.91 Allowed 'General case' 0 C--O 1.238 0.499 0 CA-C-N 119.739 1.154 . . . . 0.0 109.759 171.07 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.425 HE21 ' CG ' ' A' ' 49' ' ' ASP . 4.8 mt-30 -48.98 152.48 1.05 Allowed 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 125.687 1.595 . . . . 0.0 111.932 -172.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -70.16 -11.18 60.71 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.835 0.68 . . . . 0.0 112.835 173.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -95.79 -17.66 34.86 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 124.995 1.283 . . . . 0.0 113.57 -178.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 1.3 m -129.81 -176.48 3.93 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 119.254 1.527 . . . . 0.0 110.583 -171.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -132.21 -19.47 2.5 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 126.352 1.861 . . . . 0.0 110.612 -176.004 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -67.68 155.36 39.39 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 167.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.3 mt -102.0 165.11 11.35 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 125.079 1.352 . . . . 0.0 108.937 172.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -118.19 88.33 32.11 Favored Pre-proline 0 C--N 1.328 -0.346 0 C-N-CA 125.774 1.63 . . . . 0.0 108.468 171.413 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -62.2 128.59 24.37 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 122.682 2.255 . . . . 0.0 110.225 173.039 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -120.56 109.07 14.82 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.15 1.38 . . . . 0.0 108.056 172.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 79.0 mtm180 -66.14 -47.79 72.91 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 125.344 1.458 . . . . 0.0 113.048 -173.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.14 168.11 22.44 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 126.351 1.86 . . . . 0.0 106.508 -177.468 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 -53.56 -33.28 54.15 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 126.24 1.816 . . . . 0.0 113.628 -176.125 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -56.53 -35.29 67.92 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.49 1.516 . . . . 0.0 111.575 175.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -66.67 -47.27 73.01 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.264 1.826 . . . . 0.0 109.891 -177.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 36.1 t-105 -61.88 -41.27 97.68 Favored 'General case' 0 C--N 1.345 0.38 0 O-C-N 120.771 -1.206 . . . . 0.0 110.719 176.264 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -59.56 -54.79 42.51 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 175.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 61.7 mtp180 . . . . . 0 C--O 1.226 -0.147 0 CA-C-O 117.656 -1.164 . . . . 0.0 112.408 179.557 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 36.1 mt . . . . . 0 N--CA 1.468 0.46 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -144.83 150.38 37.03 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 121.85 0.833 . . . . 0.0 110.647 -166.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.423 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 3.4 m-85 -62.13 130.1 43.88 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 173.508 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 100.55 5.87 53.54 Favored Glycine 0 CA--C 1.527 0.833 0 CA-C-O 118.441 -1.199 . . . . 0.0 114.301 -176.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.425 ' CG ' HE21 ' A' ' 19' ' ' GLN . 5.4 m-20 -75.71 -6.76 52.07 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 115.905 1.817 . . . . 0.0 115.905 -166.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 16.2 ttmt 53.07 130.71 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 130.238 3.415 . . . . 0.0 116.692 173.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 5.9 tp -122.02 154.76 36.83 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 175.402 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 41.0 t -138.04 131.6 41.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 C-N-CA 126.587 1.955 . . . . 0.0 107.0 175.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -107.14 -178.75 3.73 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.446 1.498 . . . . 0.0 113.41 178.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.436 ' HA ' HG21 ' A' ' 102' ' ' VAL . 8.6 t -56.72 -13.94 2.91 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 128.385 2.674 . . . . 0.0 115.103 177.596 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -122.69 11.87 9.84 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 126.823 2.049 . . . . 0.0 109.733 -173.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 66.96 16.43 10.36 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.895 1.678 . . . . 0.0 110.589 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 25.0 m170 -61.45 108.53 0.96 Allowed 'General case' 0 C--O 1.24 0.565 0 CA-C-N 120.363 1.438 . . . . 0.0 107.995 168.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -82.29 149.42 27.8 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 173.556 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -138.55 164.49 29.3 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 171.087 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 25.6 t -133.27 138.78 50.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 C-N-CA 128.087 2.555 . . . . 0.0 106.425 172.188 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 16.0 tp -80.16 137.32 36.68 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 171.155 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -121.84 170.91 9.31 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.38 1.072 . . . . 0.0 110.371 174.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.625 ' H ' ' CD ' ' A' ' 63' ' ' GLU . 0.7 OUTLIER -66.99 -18.57 65.45 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.584 1.553 . . . . 0.0 111.433 -171.086 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -78.16 16.45 0.76 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.903 1.281 . . . . 0.0 110.958 172.229 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 61.45 0.97 0.5 Allowed 'General case' 0 C--O 1.239 0.549 0 C-N-CA 129.746 3.219 . . . . 0.0 114.979 176.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 2.2 p-80 -85.12 156.49 21.03 Favored 'General case' 0 N--CA 1.437 -1.105 0 CA-C-O 121.781 0.801 . . . . 0.0 109.269 175.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 81.4 m95 -83.93 142.52 30.48 Favored 'General case' 0 N--CA 1.437 -1.077 0 N-CA-C 104.801 -2.296 . . . . 0.0 104.801 153.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 22.3 t-80 -114.1 143.99 30.76 Favored Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 171.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.78 103.3 0.98 Allowed 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 124.574 3.516 . . . . 0.0 111.058 176.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -79.6 29.91 0.24 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.705 1.602 . . . . 0.0 111.857 177.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 66.5 165.47 0.12 Allowed Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 128.156 2.583 . . . . 0.0 111.705 -173.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -63.36 170.23 8.34 Favored 'Trans proline' 0 N--CA 1.45 -1.034 0 C-N-CA 121.179 1.253 . . . . 0.0 110.864 167.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 13.4 tp -123.82 145.83 48.82 Favored Pre-proline 0 C--O 1.237 0.421 0 C-N-CA 124.519 1.127 . . . . 0.0 109.211 -174.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -61.46 158.78 34.6 Favored 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 123.33 2.686 . . . . 0.0 111.484 174.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -59.2 -27.23 84.45 Favored 'Trans proline' 0 N--CA 1.457 -0.674 0 C-N-CA 122.634 2.223 . . . . 0.0 112.398 179.159 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -96.11 -12.37 24.88 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.599 0.76 . . . . 0.0 111.102 -173.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.43 -28.12 68.37 Favored Glycine 0 CA--C 1.527 0.833 0 C-N-CA 123.807 0.718 . . . . 0.0 111.753 175.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 36.4 tp -52.95 -59.23 4.78 Favored 'General case' 0 C--N 1.34 0.158 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 165.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -62.59 -20.13 64.42 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.898 1.279 . . . . 0.0 112.13 -169.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -75.48 -44.94 41.35 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.577 1.151 . . . . 0.0 111.141 172.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 41.4 mt -61.65 -44.09 97.63 Favored 'General case' 0 C--O 1.234 0.257 0 O-C-N 121.009 -1.057 . . . . 0.0 110.08 173.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 37.0 mm -56.95 -41.52 77.02 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 123.25 0.62 . . . . 0.0 109.514 173.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -50.38 -42.83 54.0 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 124.413 1.085 . . . . 0.0 112.309 -179.18 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -67.44 -43.63 80.66 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 119.1 0.864 . . . . 0.0 110.952 -179.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 -58.68 -46.38 87.36 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 177.356 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 30.5 m -60.41 -44.31 95.84 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-O 118.361 -0.828 . . . . 0.0 111.244 175.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -71.48 -27.78 63.47 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 117.623 -1.179 . . . . 0.0 112.094 -172.072 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 8.4 t -70.86 -40.77 72.11 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 119.984 1.266 . . . . 0.0 108.872 177.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 58.8 mt -89.47 -63.5 1.28 Allowed 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 -174.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 157.7 9.57 0.05 OUTLIER Glycine 0 CA--C 1.536 1.351 0 C-N-CA 125.412 1.482 . . . . 0.0 114.428 174.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 21.6 p80 . . . . . 0 N--CA 1.468 0.474 0 CA-C-N 120.354 2.077 . . . . 0.0 114.237 -150.771 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.543 0.699 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.416 HD13 ' CB ' ' A' ' 105' ' ' ALA . 75.2 mt -142.67 141.3 31.84 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 126.643 1.977 . . . . 0.0 109.37 -169.246 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 9.8 t-160 -75.75 -27.22 58.01 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.063 0.545 . . . . 0.0 112.082 -174.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 11.2 p 179.69 179.56 0.49 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.191 1.396 . . . . 0.0 109.692 -174.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.436 HG21 ' HA ' ' A' ' 54' ' ' SER . 6.5 t -64.65 -45.53 95.09 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.21 0 C-N-CA 123.58 0.752 . . . . 0.0 109.054 -178.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 6.7 tpt -62.98 -32.82 74.25 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 121.727 -0.608 . . . . 0.0 110.682 -177.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.76 -37.84 70.46 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.186 0.994 . . . . 0.0 109.491 177.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.416 ' CB ' HD13 ' A' ' 99' ' ' LEU . . . -63.74 -43.15 97.35 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 125.635 1.574 . . . . 0.0 112.455 176.159 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 33.9 mm -61.26 -50.63 79.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -179.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -66.34 -39.16 89.02 Favored 'General case' 0 C--O 1.226 -0.177 0 O-C-N 123.369 0.418 . . . . 0.0 110.326 -176.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -53.91 -56.37 18.36 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 124.548 1.139 . . . . 0.0 111.117 172.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 31.7 mt -62.43 -38.78 91.04 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 111.761 0.282 . . . . 0.0 111.761 -177.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -64.87 -41.41 95.69 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 177.244 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -70.33 -13.35 62.11 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 118.111 -0.947 . . . . 0.0 113.161 -178.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 94.9 mt . . . . . 0 N--CA 1.463 0.187 0 CA-C-N 120.082 1.31 . . . . 0.0 110.934 172.456 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.544 0.733 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -77.92 -165.08 0.31 Allowed 'Trans proline' 0 CA--C 1.548 1.185 0 C-N-CA 124.418 3.412 . . . . 0.0 111.96 179.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 26.8 t-80 -53.6 143.73 36.71 Favored Pre-proline 0 CA--C 1.539 0.541 0 C-N-CA 124.496 1.118 . . . . 0.0 110.759 -173.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -71.51 6.12 2.07 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 C-N-CA 123.907 3.071 . . . . 0.0 114.879 -177.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -125.23 -5.86 7.2 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.143 1.377 . . . . 0.0 112.317 177.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.7 tt -54.98 151.55 8.69 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 119.578 1.081 . . . . 0.0 109.931 166.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 12.6 mm -127.04 140.61 48.6 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.115 0 N-CA-C 105.928 -1.879 . . . . 0.0 105.928 174.331 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 78.9 m95 -81.04 159.96 67.04 Favored Pre-proline 0 CA--C 1.537 0.459 0 O-C-N 121.938 -0.476 . . . . 0.0 110.889 177.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.77 170.68 52.84 Favored 'Cis proline' 0 N--CA 1.455 -0.751 0 C-N-CA 124.866 -0.889 . . . . 0.0 112.621 -11.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -136.61 170.91 15.29 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.073 0.949 . . . . 0.0 111.544 -179.175 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 15.7 mt -142.68 103.38 4.21 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 127.611 2.364 . . . . 0.0 108.103 -171.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.0 tp -81.1 156.1 25.95 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 118.385 -0.817 . . . . 0.0 108.82 172.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -136.87 78.05 1.68 Allowed 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 120.321 1.419 . . . . 0.0 111.425 172.63 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -45.81 119.79 2.37 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 126.236 1.814 . . . . 0.0 110.972 -169.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.68 99.37 1.67 Allowed 'General case' 0 N--CA 1.44 -0.959 0 C-N-CA 122.958 0.503 . . . . 0.0 110.382 -164.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 132.79 -46.9 1.03 Allowed Glycine 0 CA--C 1.532 1.106 0 C-N-CA 127.743 2.592 . . . . 0.0 109.625 -173.17 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 74.9 m -68.33 -33.57 74.54 Favored 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 126.646 1.978 . . . . 0.0 114.319 -169.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.708 ' HB3' ' HB1' ' A' ' 84' ' ' ALA . 4.2 m-80 68.85 -27.04 0.15 Allowed 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 127.271 2.228 . . . . 0.0 114.422 -176.421 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -52.7 116.58 2.38 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 127.627 2.371 . . . . 0.0 109.569 169.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.669 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 4.4 mm? -73.32 136.93 44.53 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 106.908 -1.516 . . . . 0.0 106.908 168.107 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -106.73 87.07 2.58 Favored Pre-proline 0 C--O 1.239 0.529 0 C-N-CA 127.319 2.247 . . . . 0.0 108.652 -176.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -61.82 147.37 95.39 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 122.21 1.94 . . . . 0.0 109.74 176.063 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.2 mt -138.59 116.71 11.77 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 105.542 -2.021 . . . . 0.0 105.542 178.305 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 25.4 mtt-85 -82.16 -39.55 23.07 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 120.615 1.552 . . . . 0.0 114.305 -175.143 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.7 t -145.91 -177.04 5.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 120.367 1.439 . . . . 0.0 108.802 167.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.96 -25.77 58.49 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.39 1.876 . . . . 0.0 112.576 -178.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -68.24 -29.62 68.48 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.08 0.952 . . . . 0.0 111.212 173.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -70.28 -33.39 71.52 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 121.252 -0.905 . . . . 0.0 110.407 -176.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 46.1 t-105 -60.86 -32.97 72.38 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.754 -0.592 . . . . 0.0 111.35 170.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 -66.75 -42.77 85.63 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 118.474 0.579 . . . . 0.0 111.162 173.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? . . . . . 0 N--CA 1.47 0.537 0 CA-C-N 119.047 0.84 . . . . 0.0 110.243 179.817 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 90.3 mt . . . . . 0 C--O 1.24 0.575 0 N-CA-C 102.117 -3.29 . . . . 0.0 102.117 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -118.24 160.85 20.89 Favored 'General case' 0 C--O 1.234 0.284 0 O-C-N 123.858 0.724 . . . . 0.0 110.038 -170.633 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -66.04 124.01 21.42 Favored 'General case' 0 CA--C 1.514 -0.429 0 C-N-CA 120.161 -0.616 . . . . 0.0 109.362 -164.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 103.6 0.82 46.5 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-O 117.747 -1.585 . . . . 0.0 113.821 -176.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -55.8 -29.37 59.61 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.808 1.643 . . . . 0.0 113.797 -167.652 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.419 ' HA ' ' O ' ' A' ' 59' ' ' PHE . 17.5 ttmt 54.97 155.08 0.01 OUTLIER 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 128.672 2.789 . . . . 0.0 114.889 -179.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.1 mt -141.87 140.82 32.99 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.089 174.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 99.0 t -134.05 120.87 36.74 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 125.322 1.449 . . . . 0.0 108.479 177.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 26.5 p30 -99.78 173.41 6.71 Favored 'General case' 0 C--N 1.329 -0.296 1 C-N-CA 132.018 4.127 . . . . 0.0 111.181 178.745 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.25 2.69 0.05 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.837 1.655 . . . . 0.0 114.65 174.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -123.44 5.14 9.02 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.921 1.688 . . . . 0.0 110.581 -174.342 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.45 ' CE2' ' HA ' ' A' ' 75' ' ' PRO . 11.7 m-85 61.82 14.88 6.59 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.188 1.795 . . . . 0.0 112.877 172.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 8.9 m170 -66.01 109.05 2.41 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 124.708 1.203 . . . . 0.0 109.713 163.235 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 97.4 m -72.15 140.15 48.66 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 118.168 -1.413 . . . . 0.0 108.43 166.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.419 ' O ' ' HA ' ' A' ' 50' ' ' LYS . 55.1 m-85 -124.94 159.89 30.14 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-O 117.749 -1.12 . . . . 0.0 108.76 165.663 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.449 HG12 ' HB2' ' A' ' 70' ' ' ALA . 1.6 p -150.28 153.29 10.61 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.419 0 CA-C-N 120.522 1.51 . . . . 0.0 112.402 171.674 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 17.5 tp -77.87 131.9 37.72 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 126.071 1.748 . . . . 0.0 108.727 -177.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -105.75 174.61 5.81 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 123.74 0.816 . . . . 0.0 110.479 179.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -68.89 -2.42 9.62 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.272 -0.893 . . . . 0.0 112.927 172.559 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -85.87 0.78 52.17 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 120.369 -1.457 . . . . 0.0 112.153 165.006 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 51.87 8.94 0.07 Allowed 'General case' 0 C--O 1.237 0.426 0 C-N-CA 128.104 2.562 . . . . 0.0 113.953 -164.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -77.72 174.16 11.27 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 167.55 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 74.7 m95 -114.49 136.94 52.46 Favored 'General case' 0 N--CA 1.44 -0.944 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 -179.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -118.31 144.71 35.59 Favored Pre-proline 0 N--CA 1.45 -0.472 0 C-N-CA 126.013 1.725 . . . . 0.0 110.401 -170.305 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -79.28 101.97 1.47 Allowed 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 124.697 3.598 . . . . 0.0 110.073 -178.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.449 ' HB2' HG12 ' A' ' 60' ' ' VAL . . . -83.35 24.68 0.8 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.212 1.405 . . . . 0.0 112.625 179.432 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 67.8 165.11 0.13 Allowed Pre-proline 0 CA--C 1.543 0.679 0 C-N-CA 128.836 2.854 . . . . 0.0 111.99 -178.09 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -70.54 175.38 8.82 Favored 'Trans proline' 0 N--CA 1.452 -0.956 0 C-N-CA 121.263 1.309 . . . . 0.0 111.947 175.062 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 13.4 tp -126.6 155.36 74.9 Favored Pre-proline 0 CA--C 1.539 0.549 0 C-N-CA 126.813 2.045 . . . . 0.0 108.772 -172.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -73.14 165.67 32.07 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 121.793 1.662 . . . . 0.0 110.113 164.126 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.45 ' HA ' ' CE2' ' A' ' 56' ' ' PHE . 18.5 Cg_endo -59.32 -36.41 94.63 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.544 2.163 . . . . 0.0 112.459 177.767 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -78.97 -25.29 43.47 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 122.455 0.302 . . . . 0.0 110.245 -174.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.13 -24.58 67.28 Favored Glycine 0 CA--C 1.53 1.029 0 CA-C-O 119.137 -0.813 . . . . 0.0 113.189 -174.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 23.4 tp -55.09 -46.16 75.48 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 124.832 1.253 . . . . 0.0 109.962 168.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -75.39 -15.26 60.47 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 123.603 0.761 . . . . 0.0 110.632 -168.583 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -68.36 -44.84 74.34 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.063 -1.023 . . . . 0.0 110.981 164.215 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.8 mp -58.15 -56.93 15.75 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 175.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 6.0 mm -53.19 -34.19 21.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 C-N-CA 125.059 1.344 . . . . 0.0 110.986 -178.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 12.2 ttt-85 -48.02 -38.89 18.22 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 119.381 0.992 . . . . 0.0 112.559 175.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.708 ' HB1' ' HB3' ' A' ' 23' ' ' ASN . . . -71.37 -42.96 67.77 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.373 0.988 . . . . 0.0 111.773 -179.074 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.669 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 13.5 t60 -55.24 -55.05 35.72 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.778 0.799 . . . . 0.0 109.281 170.719 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 95.1 m -68.29 -29.04 67.73 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 121.324 -0.86 . . . . 0.0 111.333 -172.13 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -78.95 -24.26 44.04 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 117.373 -1.299 . . . . 0.0 112.602 178.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.4 t -92.6 -17.75 23.97 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.914 0.779 . . . . 0.0 110.821 -177.136 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 70.1 mt -107.28 -22.35 12.63 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.581 0.752 . . . . 0.0 111.877 178.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 79.96 53.83 4.09 Favored Glycine 0 C--N 1.337 0.614 0 N-CA-C 110.913 -0.875 . . . . 0.0 110.913 -177.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . 0.421 ' CD2' HD13 ' A' ' 112' ' ' LEU . 35.3 m-70 . . . . . 0 C--O 1.232 0.157 0 C-N-CA 122.969 0.508 . . . . 0.0 110.673 177.052 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 7.9 m80 . . . . . 0 N--CA 1.464 0.271 0 CA-C-O 119.067 -0.492 . . . . 0.0 111.831 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.597 HD13 ' HB2' ' A' ' 105' ' ' ALA . 84.5 mt -150.69 154.39 37.32 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 124.519 1.128 . . . . 0.0 109.655 -159.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 16.0 t-160 -83.85 -40.01 19.2 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 124.571 1.169 . . . . 0.0 111.397 173.055 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 88.8 p -172.26 -175.36 1.4 Allowed 'General case' 0 C--O 1.236 0.351 0 C-N-CA 124.241 1.017 . . . . 0.0 110.414 -171.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 67.5 t -55.0 -45.27 76.67 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.291 0 C-N-CA 125.106 1.362 . . . . 0.0 110.329 177.641 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 2.8 ttm -62.29 -45.63 92.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 118.527 0.603 . . . . 0.0 110.113 -171.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.55 -39.8 85.18 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 124.559 1.144 . . . . 0.0 110.08 173.167 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.597 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -61.62 -53.82 51.07 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 123.691 0.796 . . . . 0.0 111.566 178.363 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 32.4 mm -53.86 -47.08 64.19 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 -178.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -60.12 -51.54 69.16 Favored 'General case' 0 CA--C 1.521 -0.153 0 C-N-CA 123.71 0.804 . . . . 0.0 111.163 -179.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.401 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 13.0 t80 -53.27 -65.13 0.62 Allowed 'General case' 0 C--O 1.221 -0.42 0 C-N-CA 126.371 1.868 . . . . 0.0 110.176 178.606 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 9.2 mp -52.29 -45.12 65.36 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 125.784 1.634 . . . . 0.0 112.015 -178.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -65.35 -33.98 77.23 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 118.668 0.667 . . . . 0.0 111.548 177.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -80.57 -18.74 47.4 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.741 0.816 . . . . 0.0 112.836 177.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.421 HD13 ' CD2' ' A' ' 91' ' ' HIS . 63.6 mt . . . . . 0 CA--C 1.518 -0.251 0 C-N-CA 124.317 1.047 . . . . 0.0 110.98 173.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.238 0.489 0 N-CA-C 111.662 0.245 . . . . 0.0 111.662 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -71.91 70.23 2.91 Favored 'Trans proline' 0 N--CA 1.45 -1.062 0 C-N-CA 123.076 2.517 . . . . 0.0 110.089 169.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 75.55 148.09 0.12 Allowed Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 129.098 2.959 . . . . 0.0 113.432 -176.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -78.1 -28.74 4.61 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 122.688 2.259 . . . . 0.0 113.25 173.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -69.93 -22.34 63.2 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.701 1.137 . . . . 0.0 112.293 176.322 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 tt -63.77 135.56 56.74 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 166.368 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 3.0 tt -107.85 178.92 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.165 0 C-N-CA 124.286 1.035 . . . . 0.0 108.443 176.029 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 58.2 m95 -122.87 149.87 57.49 Favored Pre-proline 0 C--O 1.237 0.4 0 O-C-N 121.586 -0.696 . . . . 0.0 109.568 172.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -68.69 162.59 80.6 Favored 'Cis proline' 0 CA--C 1.542 0.917 0 N-CA-C 114.713 1.005 . . . . 0.0 114.713 -1.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.585 ' HA ' HD22 ' A' ' 16' ' ' LEU . . . -139.8 169.79 17.08 Favored 'General case' 0 CA--C 1.519 -0.219 0 C-N-CA 127.088 2.155 . . . . 0.0 110.967 -177.503 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.683 HD21 HG13 ' A' ' 102' ' ' VAL . 2.8 mm? -138.79 112.93 8.64 Favored 'General case' 0 N--CA 1.436 -1.164 0 C-N-CA 126.895 2.078 . . . . 0.0 108.597 -156.192 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 22.2 tp -99.72 151.51 21.15 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 123.772 0.67 . . . . 0.0 109.469 169.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.48 88.54 2.15 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 171.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.526 ' NE2' HE21 ' A' ' 46' ' ' GLN . 0.8 OUTLIER -52.94 138.0 31.17 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 118.195 0.452 . . . . 0.0 110.381 -171.649 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -59.02 109.92 0.93 Allowed 'General case' 0 N--CA 1.433 -1.321 0 C-N-CA 124.69 1.196 . . . . 0.0 108.364 178.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 110.09 -36.17 4.43 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 126.201 1.858 . . . . 0.0 112.825 -179.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 1.8 p -69.45 171.27 9.0 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 119.661 1.731 . . . . 0.0 109.151 177.083 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 11.5 m-80 -116.8 -16.49 10.62 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.622 -1.172 . . . . 0.0 108.883 172.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -76.83 109.59 10.75 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 124.359 1.064 . . . . 0.0 108.851 -170.286 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.466 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 4.1 mm? -68.74 137.22 53.88 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 108.164 -1.051 . . . . 0.0 108.164 172.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.405 HD22 ' HA ' ' A' ' 26' ' ' LEU . 0.2 OUTLIER -107.05 88.41 3.7 Favored Pre-proline 0 C--N 1.327 -0.391 0 C-N-CA 128.844 2.858 . . . . 0.0 112.786 -170.956 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -66.39 120.79 7.96 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 122.194 1.929 . . . . 0.0 111.28 174.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -111.99 107.78 16.87 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 126.805 2.042 . . . . 0.0 106.074 168.102 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 4.4 mtt-85 -59.73 -49.55 77.29 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.093 0.557 . . . . 0.0 110.206 178.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 22.3 p -140.4 174.68 10.28 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 123.348 0.659 . . . . 0.0 109.642 178.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -56.55 -36.41 69.24 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 124.543 1.137 . . . . 0.0 111.479 178.391 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.5 -30.93 71.97 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-N 118.959 0.8 . . . . 0.0 110.177 -177.617 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -69.1 -40.6 78.3 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-N 119.43 1.014 . . . . 0.0 111.197 174.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 13.0 t-105 -56.7 -43.32 80.4 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.254 0.622 . . . . 0.0 110.514 175.128 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -62.6 -55.95 22.36 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 174.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.466 0.337 0 C-N-CA 124.085 0.954 . . . . 0.0 112.726 -173.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 56.6 mt . . . . . 0 N--CA 1.456 -0.144 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.526 HE21 ' NE2' ' A' ' 19' ' ' GLN . 43.6 mt-30 -118.53 140.96 49.05 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 125.223 1.409 . . . . 0.0 108.363 -179.14 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.563 ' HA ' HD13 ' A' ' 61' ' ' LEU . 43.1 m-85 -63.79 108.99 1.58 Allowed 'General case' 0 C--O 1.234 0.259 0 N-CA-C 107.051 -1.463 . . . . 0.0 107.051 170.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 131.8 -12.58 5.36 Favored Glycine 0 CA--C 1.527 0.791 0 CA-C-O 118.919 -0.934 . . . . 0.0 112.866 -178.335 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -60.22 -10.76 4.93 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 127.134 2.173 . . . . 0.0 115.914 -166.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.6 ttmt 54.18 124.31 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 129.763 3.225 . . . . 0.0 114.786 175.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 51' ' ' LEU . 1.3 mm? -99.62 149.94 22.76 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 161.217 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 24.1 t -128.98 152.3 36.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 C-N-CA 128.327 2.651 . . . . 0.0 105.189 164.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -133.5 179.41 6.23 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.216 1.406 . . . . 0.0 110.86 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.4 m -70.28 -10.69 59.68 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 178.459 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 62.8 m-80 -85.94 -3.46 58.93 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 124.347 1.059 . . . . 0.0 111.356 170.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 60.55 23.25 12.96 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.226 1.01 . . . . 0.0 110.157 -170.22 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 49.2 m170 -75.34 114.42 13.86 Favored 'General case' 0 C--O 1.232 0.176 0 O-C-N 120.655 -1.278 . . . . 0.0 109.035 167.043 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 23.2 m -78.43 153.17 31.72 Favored 'General case' 0 C--O 1.239 0.5 0 N-CA-C 108.334 -0.988 . . . . 0.0 108.334 169.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -139.45 152.26 46.88 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.759 1.624 . . . . 0.0 107.861 171.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 63.0 t -136.29 144.25 33.52 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 127.848 2.459 . . . . 0.0 106.927 175.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.563 HD13 ' HA ' ' A' ' 47' ' ' TYR . 0.5 OUTLIER -81.02 134.41 35.67 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 127.331 2.252 . . . . 0.0 110.034 -178.493 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -109.97 168.48 9.4 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.729 1.15 . . . . 0.0 111.594 174.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -61.3 -15.09 31.92 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 120.384 -1.447 . . . . 0.0 112.876 178.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.05 -2.0 22.47 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 126.591 1.957 . . . . 0.0 112.63 171.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 74.4 -12.16 0.93 Allowed 'General case' 0 C--N 1.346 0.427 0 C-N-CA 127.009 2.124 . . . . 0.0 111.653 -175.058 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.2 p-80 -75.21 156.86 35.35 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 119.348 0.976 . . . . 0.0 112.054 177.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 65.9 m95 -104.08 96.19 6.49 Favored 'General case' 0 N--CA 1.436 -1.139 0 N-CA-C 105.211 -2.144 . . . . 0.0 105.211 174.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -81.54 161.26 62.34 Favored Pre-proline 0 C--O 1.239 0.543 0 C-N-CA 124.06 0.944 . . . . 0.0 109.847 177.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -74.34 148.95 39.28 Favored 'Trans proline' 0 N--CA 1.449 -1.095 0 C-N-CA 122.722 2.281 . . . . 0.0 109.136 -175.29 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -138.89 37.03 2.16 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.172 0.989 . . . . 0.0 110.757 -171.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 65.32 164.42 0.12 Allowed Pre-proline 0 CA--C 1.541 0.618 0 C-N-CA 129.001 2.92 . . . . 0.0 113.096 -174.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -69.97 -178.6 2.5 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 121.758 1.638 . . . . 0.0 111.699 169.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.9 tt -128.38 143.72 49.24 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 125.775 1.63 . . . . 0.0 108.858 -172.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -82.87 164.96 15.59 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.679 2.919 . . . . 0.0 111.155 -176.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -60.07 -28.32 86.78 Favored 'Trans proline' 0 CA--C 1.535 0.565 0 C-N-CA 121.612 1.542 . . . . 0.0 113.15 -178.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -84.24 -20.52 32.1 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.66 0.784 . . . . 0.0 112.731 175.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.65 -26.66 70.02 Favored Glycine 0 C--N 1.341 0.82 0 CA-C-N 119.154 0.888 . . . . 0.0 111.371 -173.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 18.5 tp -61.23 -52.3 65.35 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 126.391 1.876 . . . . 0.0 108.418 175.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -62.93 -34.95 78.54 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 123.128 0.571 . . . . 0.0 109.969 179.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.65 -32.44 73.76 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 127.055 2.142 . . . . 0.0 112.566 178.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.5 mp -67.07 -66.69 0.53 Allowed 'General case' 0 C--O 1.233 0.208 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 165.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 12.7 mm -53.65 -29.46 17.42 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 C-N-CA 125.941 1.697 . . . . 0.0 112.048 -171.103 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.7 mtp180 -44.82 -46.7 10.83 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 126.312 1.845 . . . . 0.0 110.979 173.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.74 -47.09 85.07 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.947 0.794 . . . . 0.0 111.637 179.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.466 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 7.0 t60 -59.45 -49.36 78.1 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.872 0.869 . . . . 0.0 109.822 179.547 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 84.8 m -69.17 -26.53 64.9 Favored 'General case' 0 C--N 1.329 -0.287 0 O-C-N 120.972 -1.08 . . . . 0.0 111.307 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -78.41 -14.74 59.25 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.469 1.108 . . . . 0.0 113.427 177.137 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.5 t -98.37 -16.86 19.14 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.968 0.804 . . . . 0.0 111.488 178.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 86.8 mt -109.41 -41.49 4.6 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.468 1.107 . . . . 0.0 110.84 178.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 103.83 64.8 0.69 Allowed Glycine 0 C--N 1.334 0.426 0 C-N-CA 125.093 1.33 . . . . 0.0 111.428 -178.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 10.1 m-70 . . . . . 0 C--O 1.233 0.231 0 CA-C-O 122.373 1.082 . . . . 0.0 111.46 177.491 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 5.7 m80 . . . . . 0 CA--C 1.54 0.559 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 95.3 mt -133.59 104.91 6.59 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.427 1.491 . . . . 0.0 109.186 -164.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -45.53 -40.7 8.9 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 127.877 2.471 . . . . 0.0 114.691 178.367 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 34.6 t -161.16 165.94 28.68 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 -168.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.683 HG13 HD21 ' A' ' 16' ' ' LEU . 45.5 t -61.64 -42.88 95.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 175.513 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 4.5 ttm -56.51 -44.89 81.17 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 123.752 0.821 . . . . 0.0 111.58 177.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.54 -38.42 87.1 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 110.395 -0.224 . . . . 0.0 110.395 177.865 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.98 -36.32 74.67 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 118.302 -0.856 . . . . 0.0 112.269 175.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.4 mm -57.46 -57.72 9.01 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.13 0 CA-C-N 119.389 0.995 . . . . 0.0 108.629 177.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.65 -20.97 52.88 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 118.64 0.655 . . . . 0.0 112.677 -169.416 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -55.94 -61.64 2.24 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 164.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 73.1 mt -63.57 -37.44 87.33 Favored 'General case' 0 C--O 1.232 0.141 0 C-N-CA 122.725 0.41 . . . . 0.0 110.699 -175.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -64.34 -17.6 63.86 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -176.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -100.38 -5.66 26.91 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.735 1.214 . . . . 0.0 113.462 -179.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 62.7 mt . . . . . 0 CA--C 1.534 0.329 0 CA-C-N 118.58 0.627 . . . . 0.0 110.479 173.43 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.536 0.425 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -64.59 -31.88 59.34 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 121.76 1.64 . . . . 0.0 111.512 -177.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -160.58 156.42 22.27 Favored Pre-proline 0 CA--C 1.538 0.503 0 CA-C-O 117.537 -1.22 . . . . 0.0 108.916 178.269 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -83.71 -25.14 2.56 Favored 'Trans proline' 0 CA--C 1.536 0.59 0 C-N-CA 122.566 2.178 . . . . 0.0 112.959 171.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -64.84 -18.71 65.37 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.55 1.068 . . . . 0.0 111.703 170.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 tt -77.81 123.24 26.48 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.161 0.984 . . . . 0.0 109.18 175.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.1 mm -123.59 108.57 21.2 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 N-CA-C 106.625 -1.62 . . . . 0.0 106.625 -179.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 82.6 m95 -53.83 155.49 5.94 Favored Pre-proline 0 C--O 1.237 0.431 0 C-N-CA 124.983 1.313 . . . . 0.0 113.427 -177.158 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -68.42 169.37 57.24 Favored 'Cis proline' 0 CA--C 1.534 0.493 0 N-CA-C 113.965 0.717 . . . . 0.0 113.965 -2.348 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -137.21 168.39 19.71 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 123.846 0.858 . . . . 0.0 110.79 177.216 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 14.3 mt -136.73 108.91 7.24 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 126.805 2.042 . . . . 0.0 107.242 -175.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.7 tp -81.01 144.36 31.84 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.633 -0.876 . . . . 0.0 108.633 174.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.15 94.06 2.41 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-N 118.571 0.623 . . . . 0.0 109.77 168.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -57.09 149.89 18.41 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 121.246 0.546 . . . . 0.0 110.328 -179.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -64.08 -10.04 19.94 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 171.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -109.06 0.5 31.52 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 125.831 1.681 . . . . 0.0 114.299 -175.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -142.82 178.41 7.67 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 120.176 1.988 . . . . 0.0 110.944 177.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.437 ' HB3' ' HB1' ' A' ' 84' ' ' ALA . 13.4 m-80 -121.66 -14.07 8.22 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 124.761 1.225 . . . . 0.0 109.163 176.39 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -65.71 117.16 7.74 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 107.467 -1.308 . . . . 0.0 107.467 175.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.546 ' HG ' HD13 ' A' ' 82' ' ' ILE . 3.6 mm? -74.41 136.83 42.39 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 106.897 -1.52 . . . . 0.0 106.897 168.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -110.34 87.03 5.8 Favored Pre-proline 0 C--O 1.237 0.399 0 C-N-CA 125.704 1.602 . . . . 0.0 108.491 -173.131 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -65.31 136.65 48.14 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 123.454 2.769 . . . . 0.0 110.049 -178.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.5 mt -132.93 98.26 4.25 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 -178.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.9 mmt85 -50.96 -44.11 60.51 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.487 1.515 . . . . 0.0 111.317 -177.095 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 14.4 t -160.9 -177.59 6.24 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 121.444 0.64 . . . . 0.0 109.385 -177.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -50.38 -38.83 44.66 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 125.537 1.535 . . . . 0.0 110.886 175.644 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -62.35 -33.02 73.9 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.941 0.897 . . . . 0.0 112.243 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.12 -40.15 75.04 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 121.393 -0.817 . . . . 0.0 109.607 174.509 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 47.6 t-105 -63.39 -34.03 76.84 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.214 0.606 . . . . 0.0 111.303 175.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -59.63 -62.24 2.03 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 169.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 13.2 mtt85 . . . . . 0 C--O 1.226 -0.163 0 C-N-CA 124.138 0.975 . . . . 0.0 113.548 -174.841 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.4 mt . . . . . 0 C--O 1.237 0.405 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 -143.54 151.57 40.39 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 124.259 1.024 . . . . 0.0 111.276 -167.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -63.81 115.94 5.29 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 168.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 118.93 -0.17 14.95 Favored Glycine 0 CA--C 1.527 0.835 0 CA-C-O 118.71 -1.05 . . . . 0.0 113.136 -173.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -65.32 -20.62 66.49 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 115.627 1.714 . . . . 0.0 115.627 -164.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 10.5 ttmt 44.49 137.08 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 131.385 3.874 . . . . 0.0 117.26 178.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 14.3 mt -125.65 161.94 26.12 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 114.804 -1.089 . . . . 0.0 109.392 167.503 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 95.2 t -132.38 151.78 35.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 105.533 -2.025 . . . . 0.0 105.533 158.319 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -125.51 -179.47 4.64 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 126.201 1.8 . . . . 0.0 110.828 179.079 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.3 m -64.69 -17.2 63.88 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 178.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 72.3 m-80 -77.03 -10.71 59.55 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 117.995 -1.002 . . . . 0.0 111.964 171.053 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 64.76 21.55 12.4 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 125.657 1.583 . . . . 0.0 111.658 -167.437 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 52.3 m170 -74.53 110.32 8.73 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 106.435 -1.691 . . . . 0.0 106.435 167.495 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 58.6 m -71.79 151.81 43.2 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 165.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 46.1 m-85 -143.33 160.67 40.1 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 126.461 1.905 . . . . 0.0 108.076 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 2.2 p -154.92 152.34 9.43 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.341 0 CA-C-N 120.741 1.609 . . . . 0.0 111.372 169.481 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 17.1 tp -77.98 144.01 37.11 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 125.396 1.478 . . . . 0.0 108.215 -179.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -120.67 168.19 11.66 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 125.559 1.544 . . . . 0.0 110.062 -172.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -59.64 -31.15 69.25 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 125.321 1.449 . . . . 0.0 110.841 178.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.2 2.87 11.95 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 123.619 0.767 . . . . 0.0 112.473 175.028 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 55.51 18.77 2.84 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 128.937 2.895 . . . . 0.0 113.755 176.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -84.82 -177.16 6.51 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 124.659 1.184 . . . . 0.0 108.549 154.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 50.6 m95 -112.31 154.54 25.54 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 171.026 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -124.7 150.85 66.68 Favored Pre-proline 0 C--O 1.236 0.374 0 C-N-CA 124.925 1.29 . . . . 0.0 110.221 175.686 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -71.24 111.79 3.17 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 123.75 2.967 . . . . 0.0 109.99 176.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.46 34.87 0.33 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.685 1.194 . . . . 0.0 110.807 171.326 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.83 166.64 0.12 Allowed Pre-proline 0 CA--C 1.545 0.785 0 C-N-CA 125.927 1.691 . . . . 0.0 112.131 -179.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -70.57 176.22 7.69 Favored 'Trans proline' 0 CA--C 1.535 0.571 0 C-N-CA 121.219 1.279 . . . . 0.0 111.076 166.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 20.6 tp -131.43 144.58 54.01 Favored Pre-proline 0 CA--C 1.536 0.441 0 C-N-CA 125.616 1.566 . . . . 0.0 109.324 -174.053 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -77.14 168.19 23.64 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 122.416 2.078 . . . . 0.0 109.555 176.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -59.05 -47.08 19.05 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 122.275 1.983 . . . . 0.0 112.367 178.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -79.16 -6.08 55.71 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 119.482 1.037 . . . . 0.0 110.108 -177.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.6 -24.45 67.92 Favored Glycine 0 CA--C 1.534 1.243 0 CA-C-O 118.841 -0.977 . . . . 0.0 112.972 164.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 25.6 tp -59.2 -48.08 82.94 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.588 1.694 . . . . 0.0 108.916 178.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -67.51 -7.5 26.3 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 125.421 1.488 . . . . 0.0 112.34 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -82.69 -34.94 27.2 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 121.148 1.795 . . . . 0.0 111.251 168.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -66.96 -70.76 0.23 Allowed 'General case' 0 N--CA 1.457 -0.114 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 178.19 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.546 HD13 ' HG ' ' A' ' 25' ' ' LEU . 34.0 mm -57.53 -21.03 15.02 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 C-N-CA 123.102 0.561 . . . . 0.0 112.219 -174.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.87 -47.84 11.13 Favored 'General case' 0 C--N 1.343 0.286 0 C-N-CA 124.3 1.04 . . . . 0.0 111.716 172.159 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.437 ' HB1' ' HB3' ' A' ' 23' ' ' ASN . . . -65.79 -48.85 70.38 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.23 0.612 . . . . 0.0 109.952 -171.66 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.526 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 10.5 t60 -55.31 -49.32 72.46 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 126.036 1.734 . . . . 0.0 110.01 175.713 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 90.0 m -61.64 -46.41 89.89 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.463 179.063 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.55 -40.4 94.56 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 118.877 0.762 . . . . 0.0 112.33 -178.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.4 t -78.59 7.0 7.46 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.025 0.53 . . . . 0.0 111.753 178.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.5 mt -126.83 -21.99 3.94 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.005 -1.059 . . . . 0.0 111.35 173.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 97.9 6.8 56.91 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 126.378 1.942 . . . . 0.0 113.997 -176.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 81.3 m-70 . . . . . 0 C--O 1.237 0.437 0 CA-C-N 119.404 1.602 . . . . 0.0 110.71 -174.093 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.535 0.402 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 95.0 mt -145.39 171.44 14.61 Favored 'General case' 0 C--O 1.225 -0.184 0 C-N-CA 127.478 2.311 . . . . 0.0 108.503 -166.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 27.2 t-80 -131.06 -29.56 1.84 Allowed 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 125.066 1.346 . . . . 0.0 110.135 -172.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 5.1 m -173.45 170.53 4.15 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.731 1.612 . . . . 0.0 108.681 -175.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 70.5 t -59.62 -44.0 92.39 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 172.149 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 3.4 tpt -47.34 -54.35 11.32 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.12 0.968 . . . . 0.0 109.377 174.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.63 -29.56 70.78 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.536 0.734 . . . . 0.0 112.184 -175.572 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -69.61 -48.67 59.29 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.553 1.141 . . . . 0.0 110.417 175.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 11.5 mm -59.74 -32.66 50.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 123.99 0.916 . . . . 0.0 109.723 178.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -69.0 -50.15 51.44 Favored 'General case' 0 C--N 1.338 0.091 0 C-N-CA 123.501 0.72 . . . . 0.0 110.437 175.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -54.84 -60.81 2.86 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 125.92 1.688 . . . . 0.0 111.105 178.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.8 mp -52.24 -40.92 62.29 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.412 1.085 . . . . 0.0 112.627 -179.242 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 20.5 m-80 -72.45 -28.54 63.0 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 118.881 0.764 . . . . 0.0 112.718 176.202 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -76.95 -27.53 54.85 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 121.353 -0.842 . . . . 0.0 111.296 177.028 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 40.5 mt . . . . . 0 CA--C 1.522 -0.107 0 C-N-CA 123.656 0.782 . . . . 0.0 109.401 179.729 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.24 0.577 0 CA-C-O 118.453 -0.784 . . . . 0.0 109.863 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -65.59 -47.42 4.11 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 122.262 1.975 . . . . 0.0 111.881 -177.704 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -146.58 145.94 25.15 Favored Pre-proline 0 C--O 1.234 0.281 0 N-CA-C 106.745 -1.576 . . . . 0.0 106.745 170.31 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -73.96 -34.6 5.01 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.15 1.9 . . . . 0.0 111.348 175.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -76.29 -7.75 55.6 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.994 1.317 . . . . 0.0 113.062 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.664 HD21 ' HB2' ' A' ' 15' ' ' ALA . 5.1 tt -60.05 107.73 0.67 Allowed 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.236 1.015 . . . . 0.0 108.742 170.411 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 33.3 mm -83.9 100.2 7.13 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 172.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 64.5 m95 -56.14 155.31 12.82 Favored Pre-proline 0 CA--C 1.544 0.72 0 O-C-N 121.486 -0.759 . . . . 0.0 111.696 178.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -67.79 169.34 53.82 Favored 'Cis proline' 0 N--CA 1.459 -0.544 0 C-N-CA 125.425 -0.656 . . . . 0.0 113.468 -4.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.664 ' HB2' HD21 ' A' ' 11' ' ' LEU . . . -135.64 170.24 16.28 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.515 0.726 . . . . 0.0 111.059 176.293 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 mt -136.96 106.9 6.27 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 126.951 2.1 . . . . 0.0 106.203 178.618 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.3 tp -70.26 146.87 50.34 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 105.597 -2.001 . . . . 0.0 105.597 161.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.27 88.48 2.02 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 173.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -61.41 158.11 15.38 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 123.1 1.428 . . . . 0.0 112.417 -158.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.27 134.93 40.98 Favored 'General case' 0 N--CA 1.431 -1.416 0 N-CA-C 105.598 -2.001 . . . . 0.0 105.598 178.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 88.69 -54.79 4.11 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 125.162 1.363 . . . . 0.0 111.137 -175.046 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -80.09 -13.65 59.12 Favored 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 115.327 1.603 . . . . 0.0 115.327 -159.521 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.507 ' HB3' ' HB1' ' A' ' 84' ' ' ALA . 6.5 m-80 64.47 -20.18 0.07 Allowed 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 121.664 2.029 . . . . 0.0 114.298 175.33 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -73.48 154.81 39.76 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 127.665 2.386 . . . . 0.0 109.525 178.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.9 mt -104.17 155.23 18.89 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 125.262 1.425 . . . . 0.0 109.147 -178.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -124.5 86.36 55.31 Favored Pre-proline 0 CA--C 1.538 0.506 0 C-N-CA 124.997 1.319 . . . . 0.0 108.975 177.014 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -68.68 114.82 3.65 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 124.509 3.473 . . . . 0.0 111.512 -177.667 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.8 mt -116.62 104.9 11.85 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 124.997 1.319 . . . . 0.0 108.447 -173.143 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -58.57 -44.7 89.85 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.22 0.533 . . . . 0.0 111.737 -177.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.3 p -151.44 174.47 13.33 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 124.878 1.271 . . . . 0.0 108.937 -162.301 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -69.38 -27.76 65.6 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 119.921 -0.712 . . . . 0.0 111.604 174.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -56.55 -32.8 65.49 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.298 0.954 . . . . 0.0 110.131 169.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -68.27 -42.98 78.79 Favored 'General case' 0 C--O 1.223 -0.302 0 O-C-N 120.988 -1.07 . . . . 0.0 110.05 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 31.3 t-105 -59.53 -32.19 70.08 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.514 -0.741 . . . . 0.0 112.02 174.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -65.12 -56.44 12.94 Favored 'General case' 0 CA--C 1.52 -0.178 0 O-C-N 121.067 -1.021 . . . . 0.0 109.057 175.202 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 87.3 mtm180 . . . . . 0 C--O 1.221 -0.414 0 C-N-CA 124.073 0.949 . . . . 0.0 110.259 -179.415 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 67.5 mt . . . . . 0 CA--C 1.518 -0.263 0 N-CA-C 106.375 -1.713 . . . . 0.0 106.375 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 -109.52 149.11 30.1 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 172.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.417 ' HA ' ' HB3' ' A' ' 61' ' ' LEU . 24.2 m-85 -70.16 70.62 0.39 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 126.674 1.99 . . . . 0.0 110.016 -178.181 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 160.76 2.97 0.06 OUTLIER Glycine 0 N--CA 1.439 -1.108 0 C-N-CA 123.553 0.597 . . . . 0.0 112.003 -172.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -65.35 -10.2 31.07 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 -172.412 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.7 ttmt 60.05 140.75 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 129.228 3.011 . . . . 0.0 111.997 174.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 5.7 mt -130.73 154.77 47.61 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 106.538 -1.653 . . . . 0.0 106.538 167.318 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 53.2 t -136.79 122.33 27.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 102.687 -3.079 . . . . 0.0 102.687 173.201 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -82.03 -165.54 1.02 Allowed 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 127.965 2.506 . . . . 0.0 112.486 167.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 83.6 p -73.06 -29.86 63.28 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 120.254 1.388 . . . . 0.0 114.043 176.18 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -83.18 1.47 40.44 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 126.224 1.81 . . . . 0.0 111.259 -168.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 65.46 22.7 11.89 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.615 1.966 . . . . 0.0 111.364 -173.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -66.76 112.49 4.26 Favored 'General case' 0 C--O 1.232 0.152 0 O-C-N 120.381 -1.449 . . . . 0.0 109.934 161.213 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 11.4 m -69.35 158.28 35.38 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 119.956 -0.698 . . . . 0.0 109.36 161.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -141.75 166.1 25.65 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 125.518 1.527 . . . . 0.0 109.445 172.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 34.1 t -144.46 134.44 19.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 C-N-CA 127.141 2.176 . . . . 0.0 107.209 177.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.417 ' HB3' ' HA ' ' A' ' 47' ' ' TYR . 0.2 OUTLIER -78.79 135.6 37.13 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 106.605 -1.628 . . . . 0.0 106.605 167.056 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -120.02 170.61 9.12 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 119.751 1.159 . . . . 0.0 111.92 174.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -54.91 -17.29 3.48 Favored 'General case' 0 N--CA 1.468 0.467 0 O-C-N 121.034 -1.041 . . . . 0.0 112.865 175.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -72.51 -5.29 35.94 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.551 1.14 . . . . 0.0 113.592 173.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 68.89 6.78 5.79 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 126.683 1.993 . . . . 0.0 112.574 -176.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -95.12 162.47 13.7 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 119.396 0.998 . . . . 0.0 111.667 171.648 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 56.5 m95 -107.51 78.7 1.23 Allowed 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 124.979 1.312 . . . . 0.0 108.59 178.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 63.0 t-80 -60.7 144.09 89.92 Favored Pre-proline 0 CA--C 1.545 0.75 0 CA-C-O 119.136 -0.459 . . . . 0.0 110.187 -171.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.82 113.23 3.48 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 124.103 3.202 . . . . 0.0 111.097 173.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -94.13 40.43 1.08 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.857 1.663 . . . . 0.0 111.24 -179.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.91 165.25 0.13 Allowed Pre-proline 0 CA--C 1.543 0.677 0 C-N-CA 127.856 2.462 . . . . 0.0 113.485 175.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -68.16 171.21 12.99 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.726 2.284 . . . . 0.0 112.025 167.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.0 tp -146.95 146.15 24.96 Favored Pre-proline 0 CA--C 1.534 0.335 0 C-N-CA 124.121 0.968 . . . . 0.0 111.41 -170.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -64.75 164.47 24.1 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 123.138 2.558 . . . . 0.0 113.384 171.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -61.17 -28.75 85.74 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 123.806 3.004 . . . . 0.0 112.809 174.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -82.51 -16.99 46.69 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 121.803 -0.561 . . . . 0.0 110.941 -179.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.93 -32.18 80.21 Favored Glycine 0 CA--C 1.534 1.263 0 N-CA-C 110.926 -0.87 . . . . 0.0 110.926 177.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 23.0 tp -58.71 -52.61 64.94 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.001 -1.293 . . . . 0.0 110.059 169.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -52.39 -27.33 15.3 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.885 0.874 . . . . 0.0 113.04 -174.128 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -72.07 -42.13 66.58 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.01 0.924 . . . . 0.0 112.171 178.242 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.5 mp -61.8 -44.83 96.08 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 123.909 0.884 . . . . 0.0 110.696 173.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 49.4 mm -55.83 -50.09 70.6 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 C-N-CA 123.713 0.805 . . . . 0.0 108.949 175.429 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.97 -46.19 10.96 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 125.475 1.51 . . . . 0.0 112.448 174.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.507 ' HB1' ' HB3' ' A' ' 23' ' ' ASN . . . -58.49 -51.4 70.02 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 123.457 0.473 . . . . 0.0 111.049 -177.156 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 26.5 t60 -61.24 -46.27 91.09 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.469 1.108 . . . . 0.0 110.508 177.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 73.1 m -60.97 -46.31 91.26 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 117.54 -1.219 . . . . 0.0 110.341 -178.001 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.84 -31.11 68.8 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 119.851 1.205 . . . . 0.0 112.22 -176.35 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 15.3 t -73.25 -5.88 42.32 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 117.727 -1.13 . . . . 0.0 111.878 176.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 90.0 mt -123.51 -62.33 1.32 Allowed 'General case' 0 C--N 1.342 0.267 0 CA-C-N 120.039 1.29 . . . . 0.0 110.405 -176.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 153.61 7.22 0.09 OUTLIER Glycine 0 CA--C 1.537 1.439 0 C-N-CA 126.907 2.194 . . . . 0.0 113.224 176.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 15.5 m170 . . . . . 0 N--CA 1.468 0.439 0 CA-C-N 118.645 1.222 . . . . 0.0 109.468 -160.769 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 3.5 m80 . . . . . 0 CA--C 1.542 0.64 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.491 HD13 ' HB2' ' A' ' 105' ' ' ALA . 81.4 mt -137.28 158.76 43.71 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 125.895 1.678 . . . . 0.0 110.277 -160.815 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -120.22 -20.97 7.14 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 124.062 0.945 . . . . 0.0 110.744 -163.036 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 17.2 m -160.1 173.92 15.08 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 127.177 2.191 . . . . 0.0 108.2 170.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 41.0 t -61.11 -40.58 86.23 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.307 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 168.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 4.1 ttm -60.79 -41.67 96.04 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 118.513 0.597 . . . . 0.0 110.794 -178.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -58.22 -35.03 71.07 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-O 119.187 -0.435 . . . . 0.0 110.869 174.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.491 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -65.18 -39.97 93.61 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 118.721 0.691 . . . . 0.0 111.545 179.332 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.7 mm -59.92 -51.62 70.74 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 177.193 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -62.89 -49.26 75.52 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.366 1.066 . . . . 0.0 109.795 -176.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -55.26 -52.57 62.97 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 126.621 1.968 . . . . 0.0 111.784 179.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 41.2 mt -62.22 -37.78 86.66 Favored 'General case' 0 CA--C 1.523 -0.088 0 CA-C-N 117.679 0.218 . . . . 0.0 110.8 -172.284 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -78.38 -26.36 46.53 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 122.569 0.348 . . . . 0.0 111.38 177.026 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -74.64 -25.83 59.47 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 118.628 -0.701 . . . . 0.0 112.413 174.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 13.1 mt . . . . . 0 C--O 1.233 0.23 0 CA-C-N 118.931 0.787 . . . . 0.0 110.304 177.022 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.467 0.406 0 CA-C-O 121.169 0.509 . . . . 0.0 110.994 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -163.04 148.41 15.08 Favored Glycine 0 CA--C 1.52 0.349 0 N-CA-C 109.115 -1.594 . . . . 0.0 109.115 175.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -112.99 16.38 19.38 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 118.187 0.994 . . . . 0.0 113.487 -159.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -164.17 171.99 39.86 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 108.929 -1.668 . . . . 0.0 108.929 168.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -83.72 15.19 3.35 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.881 0.872 . . . . 0.0 110.992 -173.499 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.605 HG22 HD21 ' A' ' 31' ' ' ASN . 44.1 p -66.76 158.64 79.1 Favored Pre-proline 0 CA--C 1.537 0.449 0 C-N-CA 125.78 1.632 . . . . 0.0 111.574 -166.762 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -74.11 -55.1 0.09 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.113 0 C-N-CA 120.682 0.921 . . . . 0.0 110.761 -174.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -156.09 144.58 14.58 Favored Pre-proline 0 C--O 1.237 0.414 0 N-CA-C 106.091 -1.818 . . . . 0.0 106.091 -179.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -69.57 -29.52 24.66 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.053 1.835 . . . . 0.0 110.78 174.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -82.38 -15.53 52.39 Favored 'General case' 0 N--CA 1.455 -0.2 0 O-C-N 121.916 -0.49 . . . . 0.0 112.277 -171.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.6 tt -63.0 122.46 16.1 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 170.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 21.0 mm -103.09 109.25 26.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 N-CA-C 107.167 -1.42 . . . . 0.0 107.167 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 85.6 m95 -58.81 156.35 25.52 Favored Pre-proline 0 CA--C 1.542 0.644 0 C-N-CA 124.134 0.974 . . . . 0.0 111.079 179.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -66.92 170.26 45.43 Favored 'Cis proline' 0 N--CA 1.458 -0.604 0 C-N-CA 125.303 -0.707 . . . . 0.0 113.38 -4.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -136.5 168.75 18.88 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.591 0.71 . . . . 0.0 110.678 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 18.9 mt -136.01 103.57 5.4 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 125.826 1.651 . . . . 0.0 108.027 -174.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.5 tp -87.35 143.44 27.25 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 174.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.413 ' HG2' HD22 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -138.11 83.31 1.97 Allowed 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 119.992 1.269 . . . . 0.0 110.373 179.092 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -59.7 155.27 16.15 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 123.439 0.695 . . . . 0.0 111.714 -161.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.13 139.92 58.74 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-O 123.317 1.532 . . . . 0.0 108.694 -176.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 69.12 -33.65 0.31 Allowed Glycine 0 CA--C 1.533 1.177 0 C-N-CA 127.487 2.47 . . . . 0.0 113.805 -175.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 89.8 m -76.18 176.31 8.17 Favored 'General case' 0 C--O 1.24 0.59 0 CA-C-N 120.755 2.277 . . . . 0.0 111.03 177.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.5 m-80 -128.46 -22.52 3.34 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 124.858 1.263 . . . . 0.0 111.465 -176.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -66.37 111.08 3.34 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 107.929 -1.138 . . . . 0.0 107.929 -176.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.604 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 3.2 mm? -60.09 139.14 57.67 Favored 'General case' 0 CA--C 1.512 -0.506 0 N-CA-C 107.208 -1.405 . . . . 0.0 107.208 167.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.421 HD13 ' HA ' ' A' ' 26' ' ' LEU . 0.4 OUTLIER -103.85 87.46 1.53 Allowed Pre-proline 0 C--N 1.324 -0.506 0 N-CA-C 104.579 -2.378 . . . . 0.0 104.579 176.567 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -62.54 140.95 84.42 Favored 'Trans proline' 0 N--CA 1.452 -0.956 0 N-CA-C 108.147 -1.521 . . . . 0.0 108.147 170.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.8 mt -138.5 100.29 4.06 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 104.614 -2.365 . . . . 0.0 104.614 -177.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 63.8 mtt180 -59.09 -35.93 74.24 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 118.352 0.524 . . . . 0.0 111.206 -175.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 15.0 t -161.66 -178.93 6.88 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 123.628 0.771 . . . . 0.0 109.018 -175.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.605 HD21 HG22 ' A' ' 6' ' ' THR . 0.4 OUTLIER -57.84 -28.36 64.03 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 125.497 1.519 . . . . 0.0 112.587 -179.33 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -61.52 -41.16 96.92 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.702 -0.624 . . . . 0.0 109.981 176.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -66.34 -30.84 71.32 Favored 'General case' 0 CA--C 1.522 -0.117 0 C-N-CA 123.783 0.833 . . . . 0.0 110.925 -175.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 63.5 t-105 -74.48 -43.09 57.64 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.671 0.788 . . . . 0.0 111.061 173.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -63.3 -35.44 80.38 Favored 'General case' 0 CA--C 1.528 0.13 0 O-C-N 121.698 -0.627 . . . . 0.0 110.283 176.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 63.2 mtt180 -60.76 -19.67 59.66 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.511 1.124 . . . . 0.0 112.357 173.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -64.98 -72.52 0.15 Allowed 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 120.255 1.389 . . . . 0.0 109.686 171.275 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 26.1 p -64.34 -20.66 66.25 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 120.882 -1.136 . . . . 0.0 113.267 -176.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.84 -28.19 69.85 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 122.985 0.514 . . . . 0.0 110.798 171.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -128.97 -16.11 4.16 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 -158.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.6 m -165.0 97.25 0.73 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 129.674 3.189 . . . . 0.0 109.95 171.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.7 mtpt -75.66 62.51 1.48 Allowed 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 125.703 1.601 . . . . 0.0 108.092 164.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -141.17 -171.76 3.35 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 125.001 1.321 . . . . 0.0 108.541 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . 0.3 16.4 mt 59.73 -157.39 0.33 Allowed 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 124.866 1.266 . . . . 0.0 111.975 -178.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.8 mt 75.22 84.11 0.1 Allowed 'General case' 0 CA--C 1.511 -0.529 0 C-N-CA 127.008 2.123 . . . . 0.0 109.826 162.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -88.63 152.0 22.11 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 113.779 -1.555 . . . . 0.0 109.577 -175.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.431 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 1.4 m-85 -71.54 93.27 1.19 Allowed 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 173.584 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 141.85 -5.27 2.24 Favored Glycine 0 N--CA 1.443 -0.891 0 CA-C-O 117.824 -1.542 . . . . 0.0 113.816 -163.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.55 -7.49 44.25 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 116.684 2.105 . . . . 0.0 116.684 -164.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.0 tppt? 44.65 130.89 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 131.405 3.882 . . . . 0.0 116.213 -174.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.1 mt -117.52 152.52 34.92 Favored 'General case' 0 C--N 1.331 -0.238 0 O-C-N 120.776 -1.202 . . . . 0.0 107.995 164.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 54.1 t -133.82 141.49 43.92 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 105.817 -1.919 . . . . 0.0 105.817 167.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -109.49 174.84 5.68 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 125.489 1.516 . . . . 0.0 110.448 175.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.2 m -60.89 -17.11 48.69 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -179.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -98.03 11.08 38.75 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.836 1.254 . . . . 0.0 111.308 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 64.54 24.75 13.12 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.023 1.729 . . . . 0.0 111.987 176.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 32.8 m80 -75.65 114.97 14.83 Favored 'General case' 0 C--N 1.332 -0.186 0 O-C-N 120.43 -1.418 . . . . 0.0 107.711 166.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.506 ' SG ' HD13 ' A' ' 73' ' ' LEU . 1.3 m -73.1 153.86 40.63 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 122.129 0.966 . . . . 0.0 108.949 161.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -140.33 157.54 45.39 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 126.359 1.864 . . . . 0.0 106.846 171.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 79.0 t -129.0 148.79 33.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 106.155 -1.794 . . . . 0.0 106.155 167.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 18.3 tp -86.93 144.14 27.08 Favored 'General case' 0 CA--C 1.521 -0.163 0 C-N-CA 125.925 1.69 . . . . 0.0 109.137 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -116.03 165.19 13.4 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 124.402 1.081 . . . . 0.0 110.359 -175.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.431 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 0.1 OUTLIER -68.18 -14.49 63.02 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 173.798 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -81.02 16.14 1.6 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.581 1.553 . . . . 0.0 111.823 173.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 45.78 37.36 3.38 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 126.854 2.062 . . . . 0.0 112.411 -178.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.1 p-80 -125.6 170.28 11.64 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 172.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 62.4 m95 -111.71 127.57 55.82 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 107.203 -1.406 . . . . 0.0 107.203 175.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -97.76 145.79 30.34 Favored Pre-proline 0 CA--C 1.537 0.481 0 C-N-CA 123.975 0.91 . . . . 0.0 108.966 178.201 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.26 116.01 4.52 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 123.376 2.717 . . . . 0.0 110.881 175.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -117.87 57.37 0.83 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.863 1.665 . . . . 0.0 109.568 -170.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.11 156.24 0.14 Allowed Pre-proline 0 CA--C 1.538 0.497 0 C-N-CA 129.731 3.213 . . . . 0.0 114.147 178.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -72.07 169.85 20.4 Favored 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 121.765 1.643 . . . . 0.0 110.355 161.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.506 HD13 ' SG ' ' A' ' 58' ' ' CYS . 11.3 tp -126.21 144.66 49.82 Favored Pre-proline 0 N--CA 1.451 -0.42 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.922 -167.006 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -69.95 165.28 31.72 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 121.614 1.542 . . . . 0.0 111.52 176.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -56.47 -31.11 84.79 Favored 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 123.434 2.756 . . . . 0.0 113.388 174.134 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -81.72 -15.96 52.7 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.278 1.031 . . . . 0.0 112.242 176.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -76.75 -22.15 72.83 Favored Glycine 0 CA--C 1.527 0.794 0 O-C-N 121.763 -0.586 . . . . 0.0 112.104 -174.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 29.7 tp -63.49 -48.53 77.24 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 121.694 -0.886 . . . . 0.0 109.6 164.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -53.86 -37.77 64.0 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 118.695 -0.669 . . . . 0.0 111.479 175.266 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -60.4 -34.38 73.84 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.564 1.075 . . . . 0.0 113.053 177.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.9 mp -67.8 -64.07 0.93 Allowed 'General case' 0 N--CA 1.456 -0.127 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 172.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.9 mm -60.58 -26.96 39.31 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 C-N-CA 123.681 0.792 . . . . 0.0 111.538 -170.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -44.98 -41.62 7.5 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 125.415 1.486 . . . . 0.0 110.905 168.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.56 -63.58 1.09 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.771 1.228 . . . . 0.0 111.522 176.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.604 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 7.4 t60 -55.77 -40.1 72.15 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.368 1.067 . . . . 0.0 111.267 -177.222 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 23.7 m -68.46 -51.81 39.5 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 120.38 -1.45 . . . . 0.0 110.301 177.326 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.74 -33.24 75.42 Favored 'General case' 0 C--N 1.339 0.137 0 CA-C-N 119.099 0.863 . . . . 0.0 111.887 -175.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.3 t -71.13 -28.41 64.27 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 118.403 -0.808 . . . . 0.0 109.302 -176.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 98.1 mt -88.4 -56.68 3.21 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 124.478 1.111 . . . . 0.0 110.858 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 142.99 9.45 0.51 Allowed Glycine 0 CA--C 1.532 1.118 0 CA-C-O 117.96 -1.467 . . . . 0.0 114.38 -172.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 7.3 m-70 -95.28 152.5 18.32 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 120.456 2.128 . . . . 0.0 111.877 -173.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 1.8 t -155.49 89.57 1.2 Allowed 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 125.46 1.504 . . . . 0.0 109.311 169.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 21.2 p 46.57 174.47 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.461 1 C-N-CA 131.949 4.1 . . . . 0.0 117.356 176.115 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 9.4 t -167.53 76.76 0.16 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 128.154 2.582 . . . . 0.0 106.981 -175.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.9 t 72.02 145.64 0.07 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 127.565 2.346 . . . . 0.0 112.444 -175.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.503 ' HE3' ' HB2' ' A' ' 100' ' ' HIS . 7.4 ttpt 62.85 177.59 0.15 Allowed 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 126.289 1.835 . . . . 0.0 111.856 -175.005 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 7.7 ptm -75.98 62.13 1.59 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.888 1.675 . . . . 0.0 112.022 -171.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 65.35 -72.49 0.07 Allowed 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 126.029 1.732 . . . . 0.0 110.276 -168.666 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 77.7 mt -147.4 134.71 20.64 Favored 'General case' 0 CA--C 1.512 -0.499 0 C-N-CA 124.947 1.299 . . . . 0.0 107.664 -174.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . 0.503 ' HB2' ' HE3' ' A' ' 96' ' ' LYS . 51.9 t-80 -61.92 -48.08 82.05 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 122.04 0.924 . . . . 0.0 110.536 178.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 2.8 m -164.82 -178.17 5.11 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.767 1.227 . . . . 0.0 111.296 -169.07 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 63.2 t -64.54 -38.24 82.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 CA-C-O 118.47 -0.776 . . . . 0.0 110.659 -176.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.01 -50.44 61.37 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 119.257 0.935 . . . . 0.0 109.122 177.002 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -65.53 -36.29 83.36 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.858 1.263 . . . . 0.0 110.307 -175.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.3 -48.5 81.09 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.999 0.519 . . . . 0.0 110.48 176.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 20.2 mm -65.24 -28.35 44.34 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 -178.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -69.8 -48.4 59.27 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.198 -0.939 . . . . 0.0 109.415 173.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -57.79 -65.11 0.69 Allowed 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 125.781 1.632 . . . . 0.0 111.629 -179.344 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.4 mp -49.23 -33.95 13.83 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 126.237 1.815 . . . . 0.0 113.914 -175.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -62.18 -44.99 95.38 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 118.141 0.428 . . . . 0.0 112.049 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -82.52 -8.68 59.61 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -173.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . 0.275 3.2 tp -88.37 -50.54 6.26 Favored 'General case' 0 N--CA 1.4 -2.948 0 C-N-CA 128.352 2.661 . . . . 0.0 107.51 -179.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -67.15 154.38 41.39 Favored 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 124.064 0.852 . . . . 0.0 111.19 -161.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.091 0 CA-C-O 117.409 -1.773 . . . . 0.0 112.208 -172.926 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 38.9 tpp . . . . . 0 N--CA 1.466 0.364 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -169.14 -127.79 0.95 Allowed Glycine 0 N--CA 1.445 -0.762 0 N-CA-C 104.644 -3.383 . . . . 0.0 104.644 173.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -60.24 155.58 17.28 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 123.223 0.609 . . . . 0.0 110.579 169.014 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -118.93 101.25 0.86 Allowed Glycine 0 C--N 1.33 0.249 0 N-CA-C 106.871 -2.492 . . . . 0.0 106.871 170.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 -127.44 20.74 6.69 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.623 1.969 . . . . 0.0 109.535 177.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 20.6 p -141.52 153.24 65.26 Favored Pre-proline 0 CA--C 1.535 0.386 0 C-N-CA 124.902 1.281 . . . . 0.0 110.775 -162.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.98 -55.48 0.31 Allowed 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 120.928 1.086 . . . . 0.0 111.697 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -160.82 143.78 9.69 Favored Pre-proline 0 CA--C 1.534 0.362 0 CA-C-N 119.485 1.039 . . . . 0.0 110.29 -173.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -73.84 -23.49 16.43 Favored 'Trans proline' 0 CA--C 1.531 0.372 0 C-N-CA 121.446 1.431 . . . . 0.0 113.56 -176.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 -72.25 -28.74 63.34 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-O 116.899 -1.524 . . . . 0.0 111.974 172.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.5 tt -56.33 123.59 15.14 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 120.106 1.321 . . . . 0.0 110.939 -173.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 28.0 mm -106.25 97.19 5.31 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.145 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 -177.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.48 ' CH2' ' HB2' ' A' ' 34' ' ' TRP . 81.5 m95 -51.16 144.06 15.63 Favored Pre-proline 0 C--O 1.236 0.391 0 O-C-N 123.761 0.663 . . . . 0.0 111.057 174.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -75.87 169.71 73.77 Favored 'Cis proline' 0 N--CA 1.458 -0.58 0 N-CA-C 114.142 0.785 . . . . 0.0 114.142 8.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -138.02 171.33 14.57 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 121.282 0.563 . . . . 0.0 111.496 175.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 19.3 mt -137.58 109.17 6.99 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 125.966 1.706 . . . . 0.0 108.067 -173.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 13.4 tp -94.41 137.79 33.13 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.549 1.139 . . . . 0.0 108.678 175.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -130.88 84.89 2.22 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.678 1.126 . . . . 0.0 110.959 179.342 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -46.21 132.43 9.88 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 126.982 2.113 . . . . 0.0 110.004 -175.237 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -60.71 127.68 32.84 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 122.601 1.191 . . . . 0.0 110.117 177.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 99.06 -49.53 1.23 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 126.295 1.902 . . . . 0.0 110.106 -174.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 57.1 m -67.99 169.26 10.32 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 122.831 1.3 . . . . 0.0 111.11 -178.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -129.41 -30.59 2.12 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 125.346 1.459 . . . . 0.0 108.935 -178.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -72.83 98.62 2.47 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 126.538 1.935 . . . . 0.0 108.579 -172.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.489 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 2.0 mm? -53.87 152.29 5.71 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 123.638 0.775 . . . . 0.0 110.918 -173.365 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -105.54 86.61 1.82 Allowed Pre-proline 0 C--O 1.235 0.306 0 C-N-CA 124.907 1.283 . . . . 0.0 108.197 172.26 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -66.94 142.74 63.51 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 121.832 1.688 . . . . 0.0 109.139 168.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.7 mt -145.86 109.32 4.71 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 -179.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.8 mmt85 -60.04 -47.7 84.75 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 123.644 0.777 . . . . 0.0 110.571 -176.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 45.3 p -139.86 174.64 10.31 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 124.135 0.974 . . . . 0.0 109.306 -172.217 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.75 -20.87 66.09 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.96 0.504 . . . . 0.0 111.486 173.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 48.1 m-20 -55.52 -42.5 74.62 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 123.794 0.838 . . . . 0.0 108.766 171.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -81.75 -29.64 32.77 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 123.14 0.576 . . . . 0.0 111.672 -173.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.48 ' HB2' ' CH2' ' A' ' 13' ' ' TRP . 44.7 t-105 -56.88 -45.49 82.49 Favored 'General case' 0 CA--C 1.528 0.129 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 169.537 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 66.2 mm-40 -64.33 -47.65 78.56 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 123.047 0.539 . . . . 0.0 110.367 174.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 28.1 mtt180 -53.25 -27.05 20.39 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 118.164 -0.922 . . . . 0.0 113.43 178.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -60.3 -60.68 3.42 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 120.378 1.444 . . . . 0.0 110.564 175.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 6.0 p -73.92 -30.78 62.76 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 122.823 0.449 . . . . 0.0 111.183 -172.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -68.75 -17.25 64.01 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 125.543 1.537 . . . . 0.0 111.918 175.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -126.91 28.37 5.83 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.073 0.949 . . . . 0.0 111.834 -177.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 4.4 m 52.31 27.27 4.65 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.88 1.272 . . . . 0.0 114.179 168.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.6 mmtm -48.28 -60.91 2.29 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.006 1.322 . . . . 0.0 112.676 -168.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -153.54 -176.79 5.97 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 178.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.83 178.99 0.94 Allowed 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.823 0.849 . . . . 0.0 110.879 169.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 85.2 mt -131.27 117.11 18.5 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 105.244 -2.132 . . . . 0.0 105.244 165.167 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -117.12 152.0 35.65 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 125.469 1.508 . . . . 0.0 108.731 -177.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.428 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 11.7 m-85 -58.06 138.27 56.17 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 107.092 -1.448 . . . . 0.0 107.092 167.311 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.75 3.18 80.79 Favored Glycine 0 CA--C 1.529 0.962 0 CA-C-O 117.55 -1.694 . . . . 0.0 114.872 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -65.97 -10.66 41.37 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 120.231 2.016 . . . . 0.0 115.154 -170.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 53.68 127.92 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 129.67 3.188 . . . . 0.0 115.443 176.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 13.0 mt -113.21 157.24 21.98 Favored 'General case' 0 C--N 1.328 -0.363 0 O-C-N 121.007 -1.058 . . . . 0.0 108.45 165.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 47.7 t -146.05 138.32 20.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 C-N-CA 128.379 2.672 . . . . 0.0 104.146 177.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.8 p-10 -118.15 -179.1 3.67 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 124.725 1.21 . . . . 0.0 111.347 177.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.64 -7.7 16.54 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 177.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -100.75 5.29 43.57 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.787 1.635 . . . . 0.0 111.54 174.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 59.06 20.27 8.13 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.343 1.457 . . . . 0.0 111.402 -178.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 49.5 m170 -72.35 111.77 7.83 Favored 'General case' 0 C--O 1.233 0.232 0 O-C-N 120.283 -1.511 . . . . 0.0 107.789 171.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -78.65 147.78 33.45 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 175.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -142.64 143.65 32.45 Favored 'General case' 0 N--CA 1.435 -1.222 0 CA-C-N 113.114 -1.857 . . . . 0.0 107.248 -172.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 55.5 t -127.94 146.99 32.66 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 C-N-CA 128.519 2.728 . . . . 0.0 107.128 177.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 22.2 tp -87.96 138.76 31.17 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 124.926 1.291 . . . . 0.0 107.618 171.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -117.23 169.04 9.78 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 123.666 0.786 . . . . 0.0 111.39 176.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.428 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 20.6 mp0 -57.94 -24.67 58.95 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.359 1.464 . . . . 0.0 112.55 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -71.57 -0.51 10.81 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.508 1.123 . . . . 0.0 113.386 178.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 66.02 12.16 8.26 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 128.395 2.678 . . . . 0.0 113.883 -178.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.42 ' CD2' ' HD1' ' A' ' 68' ' ' HIS . 1.3 p-80 -99.56 179.95 4.39 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 124.36 1.064 . . . . 0.0 110.517 168.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 76.6 m95 -117.47 121.55 41.33 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.49 1.516 . . . . 0.0 107.02 175.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.42 ' HD1' ' CD2' ' A' ' 66' ' ' HIS . 0.2 OUTLIER -110.78 147.71 37.03 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 125.215 1.406 . . . . 0.0 111.804 179.208 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -67.16 145.72 73.83 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.903 2.402 . . . . 0.0 112.73 -170.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -138.04 43.78 2.2 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.48 1.112 . . . . 0.0 110.852 -172.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.52 164.6 0.13 Allowed Pre-proline 0 N--CA 1.47 0.575 0 C-N-CA 128.355 2.662 . . . . 0.0 113.779 175.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -69.73 168.64 20.93 Favored 'Trans proline' 0 N--CA 1.452 -0.961 0 C-N-CA 121.343 1.362 . . . . 0.0 111.367 167.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.3 tt -123.56 143.2 40.96 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 125.105 1.362 . . . . 0.0 108.51 -172.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -79.41 163.81 24.36 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.327 2.684 . . . . 0.0 112.178 -173.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.3 -7.88 17.09 Favored 'Trans proline' 0 CA--C 1.53 0.295 0 C-N-CA 123.119 2.546 . . . . 0.0 114.741 -178.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -106.71 -16.6 14.45 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.968 1.707 . . . . 0.0 112.398 173.439 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -67.03 -29.22 74.29 Favored Glycine 0 CA--C 1.531 1.07 0 CA-C-N 119.886 1.221 . . . . 0.0 112.281 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 30.7 tp -65.32 -50.58 65.12 Favored 'General case' 0 C--N 1.34 0.16 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -60.94 -30.57 70.3 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 125.57 1.548 . . . . 0.0 110.034 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -65.99 -47.93 72.89 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 119.281 0.946 . . . . 0.0 110.106 174.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 23.2 mt -64.61 -51.13 64.25 Favored 'General case' 0 CA--C 1.52 -0.177 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 -179.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 14.8 mm -58.77 -31.85 45.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 C-N-CA 123.633 0.773 . . . . 0.0 110.899 179.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -51.88 -38.91 57.95 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 119.914 1.233 . . . . 0.0 111.702 174.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.26 -57.65 10.38 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 118.811 0.732 . . . . 0.0 111.003 176.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.489 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 21.5 t60 -55.42 -46.72 76.66 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.323 1.049 . . . . 0.0 110.038 176.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 73.3 m -72.7 -24.22 60.97 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 120.589 -1.319 . . . . 0.0 112.917 -174.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -97.3 -8.94 28.55 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.512 1.125 . . . . 0.0 112.902 -177.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.5 t -89.71 -20.98 22.95 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 167.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 63.8 mt -115.63 -21.61 9.61 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -176.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 101.22 19.74 15.71 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 115.679 1.031 . . . . 0.0 115.679 172.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . 0.763 ' CD2' HD13 ' A' ' 112' ' ' LEU . 10.4 m-70 -79.71 -31.28 41.19 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 -158.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 18.8 m 54.73 -176.55 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.553 1.541 . . . . 0.0 113.763 -172.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 3.8 m -83.19 173.29 11.79 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.273 1.029 . . . . 0.0 109.603 165.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -149.39 -62.59 0.22 Allowed 'General case' 0 C--O 1.235 0.334 0 C-N-CA 123.79 0.836 . . . . 0.0 109.649 173.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 10.0 m -70.93 -161.73 0.06 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 127.324 2.25 . . . . 0.0 110.634 177.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 47.1 pttt -58.24 128.29 36.38 Favored 'General case' 0 N--CA 1.464 0.244 0 O-C-N 120.695 -1.253 . . . . 0.0 108.301 170.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . 0.25 2.6 ptm 44.73 -163.48 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.972 2.109 . . . . 0.0 112.807 -175.645 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.42 -68.31 0.33 Allowed 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 168.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.52 HD13 ' HB2' ' A' ' 105' ' ' ALA . 81.1 mt -141.27 142.74 33.88 Favored 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -168.245 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 1.4 m170 -75.64 -36.37 60.22 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 125.038 1.461 . . . . 0.0 110.357 -174.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.6 p -164.2 -173.93 3.33 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.963 1.305 . . . . 0.0 109.977 169.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 87.7 t -60.8 -41.41 88.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 C-N-CA 124.783 1.233 . . . . 0.0 111.059 176.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.9 -46.01 78.48 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 119.677 1.126 . . . . 0.0 110.032 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -66.01 -34.26 77.69 Favored 'General case' 0 C--O 1.227 -0.098 0 C-N-CA 123.138 0.575 . . . . 0.0 110.651 178.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.52 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -55.99 -53.04 61.77 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 123.244 0.618 . . . . 0.0 110.551 175.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 30.9 mm -60.86 -34.07 57.95 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 C-N-CA 123.275 0.63 . . . . 0.0 109.805 -176.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -81.15 -27.35 35.49 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.948 0.722 . . . . 0.0 112.948 178.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.431 ' CE2' HD11 ' A' ' 112' ' ' LEU . 29.0 t80 -67.33 -65.43 0.69 Allowed 'General case' 0 C--O 1.224 -0.255 0 C-N-CA 125.299 1.44 . . . . 0.0 107.976 172.813 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.525 ' HA ' HD12 ' A' ' 112' ' ' LEU . 8.9 mp -49.88 -46.18 51.35 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.359 1.464 . . . . 0.0 112.019 -176.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -69.52 -19.94 63.71 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 119.171 0.896 . . . . 0.0 113.166 -179.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -93.41 -19.34 21.39 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 123.814 0.846 . . . . 0.0 111.541 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.763 HD13 ' CD2' ' A' ' 91' ' ' HIS . 42.1 mt -71.63 -56.49 5.74 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.404 1.082 . . . . 0.0 109.771 177.383 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -65.97 151.08 47.59 Favored 'General case' 0 C--O 1.24 0.556 0 CA-C-O 121.502 0.668 . . . . 0.0 111.13 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.065 0 CA-C-O 117.183 -1.898 . . . . 0.0 109.991 -171.075 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.5 ptp . . . . . 0 N--CA 1.472 0.63 0 CA-C-O 119.003 -0.522 . . . . 0.0 109.803 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 82.05 46.19 6.75 Favored Glycine 0 C--N 1.337 0.622 0 N-CA-C 110.104 -1.198 . . . . 0.0 110.104 -170.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -152.09 164.66 36.81 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 125.435 1.494 . . . . 0.0 109.532 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -125.28 -150.55 7.79 Favored Glycine 0 CA--C 1.523 0.566 0 C-N-CA 125.426 1.488 . . . . 0.0 110.512 -176.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -140.7 104.15 4.66 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 105.668 -1.975 . . . . 0.0 105.668 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 35.6 p -134.95 148.48 67.08 Favored Pre-proline 0 C--O 1.242 0.688 0 C-N-CA 125.272 1.429 . . . . 0.0 107.954 171.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -77.77 76.21 4.41 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 122.569 2.179 . . . . 0.0 110.014 -177.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 75.22 144.63 0.11 Allowed Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 128.052 2.541 . . . . 0.0 112.048 -178.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -82.79 -25.96 2.69 Favored 'Trans proline' 0 CA--C 1.538 0.682 0 C-N-CA 122.743 2.296 . . . . 0.0 112.836 174.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -74.67 -18.06 60.59 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 121.226 -0.921 . . . . 0.0 111.891 176.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.7 tt -61.84 115.22 3.84 Favored 'General case' 0 C--N 1.34 0.18 0 N-CA-C 107.175 -1.417 . . . . 0.0 107.175 167.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 23.7 mm -98.3 116.05 40.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 N-CA-C 106.71 -1.589 . . . . 0.0 106.71 174.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -62.44 154.18 73.46 Favored Pre-proline 0 C--O 1.239 0.551 0 CA-C-O 119.558 -0.258 . . . . 0.0 110.347 175.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -66.92 166.59 61.24 Favored 'Cis proline' 0 N--CA 1.458 -0.602 0 N-CA-C 114.615 0.967 . . . . 0.0 114.615 -0.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -131.87 168.09 18.45 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 123.438 0.695 . . . . 0.0 110.732 176.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.515 HD22 HD12 ' A' ' 25' ' ' LEU . 12.3 mt -138.93 94.79 2.86 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 126.084 1.754 . . . . 0.0 108.209 -175.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.2 tp -74.59 142.12 44.67 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 171.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.43 97.18 3.0 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 174.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -56.69 154.59 8.73 Favored 'General case' 0 N--CA 1.444 -0.734 0 O-C-N 124.436 1.085 . . . . 0.0 112.189 -169.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -68.53 124.77 24.5 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 114.672 -1.149 . . . . 0.0 108.61 174.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 99.02 -46.84 1.42 Allowed Glycine 0 CA--C 1.518 0.28 0 C-N-CA 125.383 1.468 . . . . 0.0 111.518 178.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 76.0 m -76.36 175.16 9.38 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 122.312 1.054 . . . . 0.0 111.231 178.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -125.88 -22.99 4.05 Favored 'General case' 0 C--N 1.334 -0.095 0 C-N-CA 125.164 1.386 . . . . 0.0 110.499 -174.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -62.95 121.2 12.96 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 124.732 1.213 . . . . 0.0 108.988 -177.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.515 HD12 HD22 ' A' ' 16' ' ' LEU . 3.7 mm? -74.16 150.68 40.3 Favored 'General case' 0 N--CA 1.454 -0.254 0 O-C-N 121.019 -1.051 . . . . 0.0 109.916 172.332 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -111.25 86.87 6.8 Favored Pre-proline 0 CA--C 1.532 0.279 0 C-N-CA 124.689 1.196 . . . . 0.0 108.717 173.185 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -64.39 132.88 35.16 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 121.682 1.588 . . . . 0.0 108.973 174.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.8 mt -134.56 101.28 4.9 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 -178.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.16 -38.14 87.36 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 118.559 0.618 . . . . 0.0 111.058 -169.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.0 t -151.77 180.0 7.94 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 121.964 0.887 . . . . 0.0 110.418 172.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.64 -28.79 68.83 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 125.081 1.352 . . . . 0.0 112.613 -173.414 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -59.5 -39.8 85.01 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.015 0.825 . . . . 0.0 110.439 178.255 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -60.76 -48.58 81.18 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 124.611 1.165 . . . . 0.0 109.692 177.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 25.4 t-105 -58.69 -47.96 82.74 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 123.401 0.68 . . . . 0.0 111.322 175.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -64.61 -28.34 69.56 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 123.238 0.615 . . . . 0.0 110.982 -176.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.9 mtp-105 -75.83 -38.59 57.92 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.392 0.677 . . . . 0.0 112.034 168.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 20.7 t80 -61.61 -63.05 1.4 Allowed 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.377 1.071 . . . . 0.0 109.685 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 28.8 p -71.87 -21.63 61.63 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -172.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.94 -55.43 29.58 Favored 'General case' 0 C--N 1.333 -0.126 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 172.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -74.75 3.05 8.64 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 177.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 62.0 m 60.52 -46.58 0.1 Allowed 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 128.9 2.88 . . . . 0.0 113.497 -163.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.36 -39.49 0.15 Allowed 'General case' 0 CA--C 1.519 -0.215 0 C-N-CA 130.611 3.564 . . . . 0.0 112.791 -171.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -154.89 -178.36 7.17 Favored 'General case' 0 N--CA 1.428 -1.542 0 C-N-CA 126.118 1.767 . . . . 0.0 111.564 178.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.54 118.93 10.18 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 126.444 1.898 . . . . 0.0 108.593 162.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.0 mt -92.01 120.35 32.57 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 174.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -111.56 148.49 33.13 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 124.498 1.119 . . . . 0.0 109.755 -170.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.403 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 13.0 m-85 -57.96 134.84 56.71 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 161.553 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 89.56 3.86 74.11 Favored Glycine 0 CA--C 1.531 1.057 0 CA-C-O 118.526 -1.152 . . . . 0.0 115.256 -177.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -70.25 -2.7 14.11 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 120.206 2.003 . . . . 0.0 115.675 -170.274 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.4 ttmm 45.96 117.28 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 130.94 3.696 . . . . 0.0 115.685 170.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 12.9 mt -103.35 159.79 15.26 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.324 167.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 91.1 t -137.0 154.91 31.95 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 C-N-CA 127.369 2.267 . . . . 0.0 105.09 163.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -123.69 -177.25 3.68 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.966 2.106 . . . . 0.0 111.496 -178.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.71 3.03 4.43 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.796 1.639 . . . . 0.0 113.247 178.246 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -123.55 16.71 9.63 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.696 1.998 . . . . 0.0 111.111 177.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 62.74 18.89 11.03 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.904 1.282 . . . . 0.0 111.889 175.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -70.87 108.47 4.52 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 119.959 -1.713 . . . . 0.0 108.672 170.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 56.5 m -69.49 151.06 46.5 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 119.451 -0.899 . . . . 0.0 108.576 164.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -137.37 161.07 37.28 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 125.241 1.416 . . . . 0.0 108.252 169.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 25.6 t -134.78 137.67 50.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 C-N-CA 130.288 3.435 . . . . 0.0 106.018 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 16.1 tp -85.84 133.21 33.98 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 170.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -110.1 174.31 5.92 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.534 1.134 . . . . 0.0 110.843 176.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.403 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 52.6 mt-10 -59.9 -18.61 46.11 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.989 1.716 . . . . 0.0 112.682 176.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -76.3 -7.62 55.32 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.167 0.987 . . . . 0.0 112.033 173.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 60.3 6.76 1.09 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 128.854 2.861 . . . . 0.0 114.815 -171.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 2.1 p-80 -76.11 161.78 28.56 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 119.641 1.11 . . . . 0.0 110.261 164.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 66.1 m95 -103.72 90.77 3.75 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 125.276 1.43 . . . . 0.0 107.943 176.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -78.62 163.41 61.28 Favored Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 124.53 1.132 . . . . 0.0 110.867 179.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.64 162.13 40.43 Favored 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.337 2.025 . . . . 0.0 110.595 -176.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -150.34 45.08 0.88 Allowed 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.348 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 69.03 165.11 0.13 Allowed Pre-proline 0 C--O 1.239 0.548 0 C-N-CA 127.375 2.27 . . . . 0.0 111.193 -174.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -72.82 -175.73 2.02 Favored 'Trans proline' 0 N--CA 1.447 -1.231 0 C-N-CA 121.409 1.406 . . . . 0.0 109.726 162.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.403 HD21 ' C ' ' A' ' 77' ' ' GLY . 8.4 tt -129.78 143.41 48.91 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 124.615 1.166 . . . . 0.0 107.935 -174.548 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -81.54 166.41 17.76 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.85 2.367 . . . . 0.0 110.645 -175.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -60.5 -26.36 82.63 Favored 'Trans proline' 0 CA--C 1.536 0.599 0 C-N-CA 121.153 1.236 . . . . 0.0 112.588 179.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -84.29 -18.0 37.79 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 124.892 1.277 . . . . 0.0 113.078 176.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.403 ' C ' HD21 ' A' ' 73' ' ' LEU . . . -72.45 -25.02 75.29 Favored Glycine 0 C--N 1.341 0.83 0 N-CA-C 111.225 -0.75 . . . . 0.0 111.225 -173.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 26.8 tp -65.02 -49.63 69.43 Favored 'General case' 0 C--N 1.339 0.131 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 177.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -56.58 -39.34 73.34 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.066 0.947 . . . . 0.0 109.304 173.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -65.9 -34.32 77.85 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.696 0.798 . . . . 0.0 112.146 178.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.7 mp -62.17 -64.0 1.07 Allowed 'General case' 0 C--N 1.34 0.173 0 O-C-N 121.076 -1.015 . . . . 0.0 109.044 168.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.467 HD12 HD11 ' A' ' 109' ' ' LEU . 32.9 mm -60.37 -26.96 38.68 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 123.167 0.587 . . . . 0.0 110.987 -170.38 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.74 -41.08 6.55 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 125.921 1.688 . . . . 0.0 111.714 169.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.45 -57.79 7.43 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 118.949 0.795 . . . . 0.0 110.765 -176.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.42 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 13.8 t60 -54.62 -48.01 72.73 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.659 1.184 . . . . 0.0 110.112 174.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 58.3 m -65.29 -37.01 85.83 Favored 'General case' 0 C--O 1.225 -0.199 0 O-C-N 120.849 -1.157 . . . . 0.0 111.231 -177.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -77.95 -16.91 57.78 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 119.154 0.888 . . . . 0.0 112.525 -178.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . 0.257 2.0 t -89.53 -30.27 18.34 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 119.51 1.05 . . . . 0.0 110.035 174.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 80.0 mt -96.07 -9.69 30.25 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 119.403 1.001 . . . . 0.0 112.966 178.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 73.16 28.82 65.57 Favored Glycine 0 CA--C 1.527 0.843 0 C-N-CA 125.453 1.501 . . . . 0.0 113.822 -178.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . 0.628 ' CD2' HD13 ' A' ' 112' ' ' LEU . 27.4 m-70 -80.05 169.93 17.15 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 118.497 1.149 . . . . 0.0 111.871 -176.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 70.9 m -111.63 162.27 15.36 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.643 1.577 . . . . 0.0 110.563 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 16.4 p -83.05 6.2 19.73 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 114.417 1.266 . . . . 0.0 114.417 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 23.4 p 60.21 -164.78 0.22 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.091 0.957 . . . . 0.0 110.475 175.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 35.0 m -86.7 -173.04 4.29 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 164.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 64.13 27.26 14.05 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 119.386 0.994 . . . . 0.0 112.674 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 8.3 tmm? 44.84 71.69 0.25 Allowed 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.617 1.567 . . . . 0.0 110.573 177.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 66.6 m80 58.98 -85.48 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.52 1.128 . . . . 0.0 111.189 -166.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.639 HD13 ' HB2' ' A' ' 105' ' ' ALA . 97.8 mt -148.93 134.6 18.75 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.133 0.973 . . . . 0.0 108.883 -152.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 41.4 t-80 -69.39 -39.2 78.13 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 120.869 0.366 . . . . 0.0 111.253 178.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 5.2 t -164.29 -174.14 3.39 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.194 1.398 . . . . 0.0 108.895 176.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 88.9 t -61.05 -37.68 77.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 C-N-CA 125.622 1.569 . . . . 0.0 111.585 -176.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 11.4 ttm -57.56 -48.19 80.0 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 118.933 0.788 . . . . 0.0 110.286 177.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -54.34 -41.35 68.99 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 125.704 1.602 . . . . 0.0 110.254 -177.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.639 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -54.47 -47.9 72.41 Favored 'General case' 0 C--O 1.227 -0.113 0 C-N-CA 125.026 1.33 . . . . 0.0 111.766 177.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 38.5 mm -61.73 -43.72 97.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 -176.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -68.08 -34.49 76.5 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 118.671 -0.681 . . . . 0.0 111.398 178.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.492 ' CE2' HD11 ' A' ' 112' ' ' LEU . 33.0 t80 -60.47 -65.57 0.67 Allowed 'General case' 0 C--O 1.226 -0.133 0 C-N-CA 123.889 0.876 . . . . 0.0 109.433 174.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.467 HD11 HD12 ' A' ' 82' ' ' ILE . 8.0 mp -48.16 -49.91 30.77 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 125.246 1.418 . . . . 0.0 111.766 178.194 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 16.7 m-80 -65.54 -31.7 72.89 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 118.781 -0.628 . . . . 0.0 112.358 -178.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -75.86 -27.46 57.8 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 117.985 -1.007 . . . . 0.0 111.292 176.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.628 HD13 ' CD2' ' A' ' 91' ' ' HIS . 59.8 mt -63.4 -64.68 0.84 Allowed 'General case' 0 N--CA 1.457 -0.111 0 CA-C-N 119.406 1.003 . . . . 0.0 108.789 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 44.56 50.78 8.22 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 126.144 1.777 . . . . 0.0 111.445 -169.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.677 0 N-CA-C 108.774 -1.731 . . . . 0.0 108.774 167.917 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.4 ttm . . . . . 0 N--CA 1.469 0.486 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -64.68 162.11 38.53 Favored Glycine 0 C--N 1.339 0.745 0 CA-C-N 119.681 1.128 . . . . 0.0 110.874 172.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -145.92 106.99 4.15 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 124.489 1.116 . . . . 0.0 108.004 179.086 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 75.66 160.02 8.67 Favored Glycine 0 C--N 1.33 0.242 0 N-CA-C 110.019 -1.232 . . . . 0.0 110.019 -161.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 60.97 9.44 2.31 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 115.246 1.572 . . . . 0.0 115.246 170.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 29.3 p -70.16 144.81 92.96 Favored Pre-proline 0 C--N 1.324 -0.505 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 157.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -73.49 94.63 0.85 Allowed 'Trans proline' 0 N--CA 1.444 -1.432 0 C-N-CA 121.837 1.691 . . . . 0.0 108.728 174.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 75.17 147.27 0.12 Allowed Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 128.35 2.66 . . . . 0.0 111.873 -174.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -79.39 -32.35 1.73 Allowed 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 123.264 2.643 . . . . 0.0 112.379 170.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -83.87 -6.6 59.46 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.851 1.26 . . . . 0.0 112.764 -176.04 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.44 132.29 49.6 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.838 1.255 . . . . 0.0 108.105 164.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.8 mm -115.33 115.83 50.61 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.131 0 C-N-CA 124.823 1.249 . . . . 0.0 107.966 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 71.2 m95 -60.6 151.33 71.44 Favored Pre-proline 0 C--O 1.235 0.296 0 C-N-CA 123.494 0.718 . . . . 0.0 111.725 177.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -72.32 174.15 49.54 Favored 'Cis proline' 0 CA--C 1.537 0.65 0 N-CA-C 115.266 1.218 . . . . 0.0 115.266 0.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -128.81 166.77 18.39 Favored 'General case' 0 C--N 1.344 0.339 0 C-N-CA 123.39 0.676 . . . . 0.0 112.817 -179.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 18.1 mt -139.49 99.63 3.78 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 127.795 2.438 . . . . 0.0 107.937 178.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 23.8 tp -70.44 152.95 43.49 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 117.883 -1.056 . . . . 0.0 108.444 169.41 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.424 ' HG2' ' HG ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -144.87 85.95 1.77 Allowed 'General case' 0 C--O 1.234 0.267 0 CA-C-N 120.238 1.381 . . . . 0.0 111.588 170.805 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -44.45 127.28 5.82 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 125.728 1.611 . . . . 0.0 110.517 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.4 tp60 -68.49 90.77 0.39 Allowed 'General case' 0 N--CA 1.432 -1.366 0 C-N-CA 126.036 1.735 . . . . 0.0 111.142 -170.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 115.06 -17.55 17.12 Favored Glycine 0 CA--C 1.524 0.627 0 CA-C-O 118.267 -1.296 . . . . 0.0 112.173 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.422 ' C ' ' H ' ' A' ' 24' ' ' GLU . 3.8 t -71.38 -33.35 69.45 Favored 'General case' 0 C--O 1.22 -0.454 0 CA-C-N 118.881 1.341 . . . . 0.0 109.957 173.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.605 ' HB3' ' HB1' ' A' ' 84' ' ' ALA . 7.9 m-80 68.7 -20.83 0.15 Allowed 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.908 1.683 . . . . 0.0 112.552 -172.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.422 ' H ' ' C ' ' A' ' 22' ' ' CYS . 23.3 tt0 -64.86 138.26 58.27 Favored 'General case' 0 N--CA 1.441 -0.918 0 C-N-CA 125.308 1.443 . . . . 0.0 108.352 172.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.757 HD13 HD13 ' A' ' 82' ' ' ILE . 1.3 mt -96.98 150.6 20.58 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 124.164 0.986 . . . . 0.0 108.519 169.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -113.73 87.83 12.85 Favored Pre-proline 0 C--N 1.327 -0.403 0 C-N-CA 124.768 1.227 . . . . 0.0 110.226 175.104 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -64.23 137.43 56.33 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 123.083 2.522 . . . . 0.0 109.994 176.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.7 mt -141.47 117.12 10.32 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 106.783 -1.562 . . . . 0.0 106.783 -177.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -69.0 -53.59 19.74 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.235 0.541 . . . . 0.0 112.03 -173.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 64.3 p -138.85 165.11 27.89 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.983 0.913 . . . . 0.0 108.612 -175.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -50.59 -30.85 14.25 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 123.384 0.674 . . . . 0.0 112.652 -177.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.9 -42.54 76.15 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.257 1.023 . . . . 0.0 111.595 174.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.44 -47.32 79.53 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 121.216 -0.927 . . . . 0.0 110.484 179.038 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 41.0 t-105 -58.06 -47.04 84.35 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 176.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 -55.09 -58.41 7.76 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.474 0.709 . . . . 0.0 109.444 178.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -64.64 -14.66 59.07 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 125.336 1.455 . . . . 0.0 113.587 -178.166 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.47 ' CZ ' ' CD2' ' A' ' 43' ' ' HIS . 44.8 t80 -79.1 -63.39 1.43 Allowed 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 173.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 8.7 t -66.48 -29.32 69.41 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.295 -0.878 . . . . 0.0 111.586 -176.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.78 -13.82 62.47 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 124.531 1.132 . . . . 0.0 112.091 -178.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -109.93 6.16 22.98 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 119.322 0.965 . . . . 0.0 111.737 -174.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 48.84 40.32 16.16 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.865 1.666 . . . . 0.0 111.936 -170.46 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -51.45 -42.12 61.34 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 123.499 0.72 . . . . 0.0 111.241 178.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.47 ' CD2' ' CZ ' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -151.1 -167.17 2.74 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.45 1.5 . . . . 0.0 107.622 -173.488 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.564 ' N ' HD12 ' A' ' 44' ' ' LEU . 1.7 mp -123.51 125.34 44.72 Favored 'General case' 0 CA--C 1.513 -0.475 0 C-N-CA 124.807 1.243 . . . . 0.0 109.734 -178.285 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 85.1 mt -82.67 134.99 35.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.308 0.575 . . . . 0.0 109.637 171.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -149.85 162.33 40.51 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.616 1.166 . . . . 0.0 109.051 -173.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -71.39 105.01 3.37 Favored 'General case' 0 C--O 1.237 0.443 0 O-C-N 121.612 -0.68 . . . . 0.0 109.217 -163.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 122.47 5.31 8.61 Favored Glycine 0 CA--C 1.526 0.748 0 CA-C-O 117.433 -1.759 . . . . 0.0 114.787 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.95 -15.58 1.45 Allowed 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 117.255 2.317 . . . . 0.0 117.255 -175.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.5 ttmt 44.63 125.67 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.221 1 C-N-CA 132.171 4.188 . . . . 0.0 115.295 -177.005 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.7 mt -109.99 139.42 45.11 Favored 'General case' 0 CA--C 1.512 -0.51 0 O-C-N 120.942 -1.099 . . . . 0.0 108.089 166.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 55.2 t -113.01 151.29 14.92 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 N-CA-C 105.098 -2.186 . . . . 0.0 105.098 162.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -131.22 172.19 12.42 Favored 'General case' 0 N--CA 1.437 -1.118 0 C-N-CA 130.294 3.438 . . . . 0.0 108.617 -177.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.7 t -56.71 -20.69 23.11 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.36 1.464 . . . . 0.0 113.048 177.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -98.35 -0.09 44.43 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.096 1.758 . . . . 0.0 112.619 -169.641 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 59.63 15.3 4.55 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.989 1.716 . . . . 0.0 112.54 -171.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 48.1 m170 -70.18 106.4 3.28 Favored 'General case' 0 CA--C 1.529 0.15 0 O-C-N 120.076 -1.64 . . . . 0.0 109.638 164.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 2.9 t -71.86 151.57 43.3 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 174.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -139.1 153.77 48.06 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 124.55 1.14 . . . . 0.0 108.757 176.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 27.8 t -141.91 135.41 29.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 C-N-CA 127.526 2.33 . . . . 0.0 107.336 -176.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 29.5 tp -80.7 133.44 35.69 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 126.051 1.74 . . . . 0.0 107.719 176.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -125.83 170.35 11.71 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.14 0.976 . . . . 0.0 109.441 178.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -66.57 -29.3 69.34 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.12 0.968 . . . . 0.0 112.001 -167.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -66.73 8.8 0.22 Allowed 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.795 1.238 . . . . 0.0 112.954 171.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 63.48 28.25 15.31 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 126.434 1.894 . . . . 0.0 111.674 168.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.4 p-80 -114.75 166.52 11.66 Favored 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 124.948 1.299 . . . . 0.0 110.191 170.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 65.3 m95 -103.71 98.09 8.01 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 126.638 1.975 . . . . 0.0 106.785 174.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 63.3 t-80 -71.08 143.52 88.79 Favored Pre-proline 0 CA--C 1.539 0.55 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 178.17 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -72.08 113.39 3.67 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 123.806 3.004 . . . . 0.0 109.669 172.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -91.89 34.54 1.0 Allowed 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.95 1.7 . . . . 0.0 111.99 -173.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.534 ' HB1' ' HD2' ' A' ' 72' ' ' PRO . . . 64.89 166.27 0.12 Allowed Pre-proline 0 CA--C 1.547 0.849 0 C-N-CA 126.684 1.994 . . . . 0.0 111.759 -175.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.534 ' HD2' ' HB1' ' A' ' 71' ' ' ALA . 62.0 Cg_endo -67.03 -177.8 1.13 Allowed 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 121.931 1.754 . . . . 0.0 112.626 178.425 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.2 tt -132.61 143.88 50.62 Favored Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 126.053 1.741 . . . . 0.0 108.745 -175.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -80.83 164.4 20.41 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 123.005 2.47 . . . . 0.0 111.968 -176.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -61.44 -10.87 17.41 Favored 'Trans proline' 0 CA--C 1.528 0.224 0 C-N-CA 123.013 2.475 . . . . 0.0 115.441 178.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -106.34 -15.59 14.79 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.043 1.737 . . . . 0.0 113.505 175.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.59 -37.99 95.59 Favored Glycine 0 CA--C 1.529 0.93 0 CA-C-N 119.051 0.841 . . . . 0.0 111.301 -177.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.3 tp -52.74 -47.74 67.18 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 125.291 1.436 . . . . 0.0 108.384 177.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -75.64 -17.34 60.02 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 127.625 2.37 . . . . 0.0 110.527 -170.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -84.31 -42.39 15.86 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.043 1.337 . . . . 0.0 110.502 170.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.5 mp -58.99 -52.74 64.46 Favored 'General case' 0 N--CA 1.46 0.073 0 C-N-CA 123.196 0.598 . . . . 0.0 109.895 176.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.757 HD13 HD13 ' A' ' 25' ' ' LEU . 4.1 mm -62.1 -33.51 58.84 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.148 0 C-N-CA 123.675 0.79 . . . . 0.0 110.653 178.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.86 -42.36 58.8 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 121.455 -0.778 . . . . 0.0 110.923 171.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.605 ' HB1' ' HB3' ' A' ' 23' ' ' ASN . . . -65.75 -42.64 90.68 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 118.997 -0.525 . . . . 0.0 112.3 -177.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.571 ' CB ' HD12 ' A' ' 25' ' ' LEU . 7.8 t60 -60.14 -53.44 57.77 Favored 'General case' 0 C--O 1.222 -0.346 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 172.547 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 94.8 m -57.03 -42.24 80.07 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 121.361 -0.837 . . . . 0.0 110.201 -174.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.42 -22.26 66.78 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-O 116.832 -1.556 . . . . 0.0 114.239 -178.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.444 HG23 ' CD2' ' A' ' 89' ' ' LEU 0.377 11.8 t -93.57 -13.39 27.77 Favored 'General case' 0 C--N 1.345 0.403 0 CA-C-N 121.3 1.863 . . . . 0.0 110.925 -177.06 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.444 ' CD2' HG23 ' A' ' 88' ' ' THR . 1.0 OUTLIER -107.85 -14.61 14.74 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 126.322 1.849 . . . . 0.0 111.625 -179.248 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 77.87 15.21 81.49 Favored Glycine 0 CA--C 1.53 0.988 0 CA-C-O 118.416 -1.214 . . . . 0.0 113.27 -172.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 69.2 m-70 -75.76 160.56 29.88 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 119.163 1.482 . . . . 0.0 109.57 -178.003 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 59.7 m -109.26 163.38 13.42 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 123.515 0.726 . . . . 0.0 109.855 177.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 34.7 m -55.88 164.27 1.22 Allowed 'General case' 0 C--O 1.237 0.442 0 C-N-CA 124.313 1.045 . . . . 0.0 110.138 160.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 66.2 p -119.88 -163.02 0.96 Allowed 'General case' 0 C--O 1.239 0.53 0 C-N-CA 126.847 2.059 . . . . 0.0 106.902 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.38 169.6 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.19 0.996 . . . . 0.0 111.903 171.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.456 ' HE2' ' HB2' ' A' ' 100' ' ' HIS 0.285 0.0 OUTLIER 53.29 -170.71 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.4 1.48 . . . . 0.0 112.503 -176.938 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.09 77.3 4.6 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 178.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 4.6 t-160 67.01 -75.17 0.06 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.502 1.521 . . . . 0.0 109.749 -177.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 93.3 mt -141.63 153.56 44.83 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 121.851 2.114 . . . . 0.0 110.639 174.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . 0.456 ' HB2' ' HE2' ' A' ' 96' ' ' LYS . 23.9 t-80 -75.37 -39.25 59.45 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.716 175.402 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -175.05 178.28 1.79 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 122.948 0.499 . . . . 0.0 111.464 -167.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 58.4 t -64.45 -39.47 85.68 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 123.653 0.781 . . . . 0.0 109.892 -176.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 3.5 tpt -56.92 -32.1 65.6 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.795 -0.566 . . . . 0.0 111.796 177.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -72.2 -48.74 40.8 Favored 'General case' 0 C--O 1.226 -0.176 0 C-N-CA 124.429 1.091 . . . . 0.0 108.221 176.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.06 -50.08 67.54 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 125.224 1.41 . . . . 0.0 112.542 -178.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 37.6 mm -57.17 -45.81 84.58 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -178.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -74.03 -24.73 59.59 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.279 1.032 . . . . 0.0 112.733 -175.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -67.26 -70.46 0.25 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.993 0.917 . . . . 0.0 109.088 168.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 9.4 mp -51.39 -51.19 56.81 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 127.02 2.128 . . . . 0.0 113.298 -177.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -64.23 -12.6 42.39 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 118.186 -0.911 . . . . 0.0 112.28 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -100.85 -7.25 23.74 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 120.105 1.32 . . . . 0.0 112.303 175.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 95.8 mt -90.37 -47.71 7.57 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.79 1.236 . . . . 0.0 110.194 173.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -74.18 149.72 40.78 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 122.899 0.48 . . . . 0.0 110.626 -173.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.284 0 N-CA-C 106.913 -2.475 . . . . 0.0 106.913 -169.162 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.657 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 125.11 133.94 4.07 Favored Glycine 0 C--N 1.334 0.447 0 C-N-CA 126.089 1.804 . . . . 0.0 109.341 176.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -98.13 -160.21 0.79 Allowed 'General case' 0 C--O 1.238 0.478 0 C-N-CA 124.862 1.265 . . . . 0.0 110.351 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 141.52 -66.68 0.49 Allowed Glycine 0 C--N 1.338 0.645 0 O-C-N 121.402 -0.811 . . . . 0.0 114.2 171.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.0 mp0 -129.45 10.77 5.74 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.034 1.334 . . . . 0.0 112.501 -164.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -144.43 161.45 44.19 Favored Pre-proline 0 C--N 1.325 -0.475 0 C-N-CA 126.903 2.081 . . . . 0.0 109.159 -173.099 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -69.16 -55.33 0.2 Allowed 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 121.009 1.139 . . . . 0.0 110.555 -167.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . 0.409 ' CD2' ' HD2' ' A' ' 9' ' ' PRO . 5.4 t-80 -144.5 148.36 40.0 Favored Pre-proline 0 N--CA 1.451 -0.407 0 C-N-CA 126.614 1.965 . . . . 0.0 106.409 172.726 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.409 ' HD2' ' CD2' ' A' ' 8' ' ' HIS . 51.9 Cg_endo -72.96 -28.98 12.53 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 CA-C-N 120.919 1.364 . . . . 0.0 112.658 179.409 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -80.63 -10.02 59.76 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 118.726 -0.654 . . . . 0.0 112.06 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.5 tt -58.76 132.65 54.54 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 119.084 0.856 . . . . 0.0 109.851 168.411 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.449 ' CG1' HD21 ' A' ' 55' ' ' ASN . 45.6 mm -113.77 113.01 42.67 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 175.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 76.6 m95 -57.8 150.11 49.9 Favored Pre-proline 0 C--O 1.241 0.637 0 C-N-CA 123.255 0.622 . . . . 0.0 111.346 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -71.72 173.22 52.2 Favored 'Cis proline' 0 CA--C 1.54 0.785 0 N-CA-C 114.768 1.026 . . . . 0.0 114.768 0.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -131.17 167.47 19.1 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 124.29 1.036 . . . . 0.0 111.818 176.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.402 ' HA ' HD23 ' A' ' 16' ' ' LEU . 27.1 mt -139.54 105.09 5.09 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 126.851 2.061 . . . . 0.0 110.031 -175.269 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.476 HD23 ' CZ3' ' A' ' 34' ' ' TRP . 0.2 OUTLIER -81.56 165.01 21.52 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 123.602 0.761 . . . . 0.0 109.592 168.534 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.451 ' H ' HD13 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -156.64 88.04 1.04 Allowed 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 119.445 -0.312 . . . . 0.0 110.445 163.248 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 22.5 mt-30 -51.6 135.6 28.12 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -166.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -68.26 116.73 9.19 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 -176.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 105.3 -2.79 40.19 Favored Glycine 0 CA--C 1.525 0.704 0 CA-C-O 117.398 -1.779 . . . . 0.0 113.615 -173.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.83 172.75 7.94 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 119.956 1.878 . . . . 0.0 109.929 165.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.417 ' HB3' ' HB1' ' A' ' 84' ' ' ALA . 8.3 m-80 -110.95 -17.62 13.26 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 125.501 1.52 . . . . 0.0 108.881 177.068 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -76.24 127.98 34.0 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 -177.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.42 HD23 ' HB2' ' A' ' 18' ' ' LYS . 1.3 mt -82.53 159.51 22.81 Favored 'General case' 0 C--O 1.231 0.1 0 C-N-CA 123.48 0.712 . . . . 0.0 109.539 170.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -122.6 88.95 49.79 Favored Pre-proline 0 C--N 1.328 -0.33 0 C-N-CA 125.665 1.586 . . . . 0.0 110.71 -173.475 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -62.09 126.3 18.39 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 123.777 2.985 . . . . 0.0 109.961 179.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -115.28 100.37 8.08 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 107.154 -1.425 . . . . 0.0 107.154 169.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 67.5 mtt-85 -52.64 -53.16 50.81 Favored 'General case' 0 N--CA 1.463 0.196 0 C-N-CA 124.584 1.154 . . . . 0.0 110.59 175.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.0 t -144.23 -177.75 5.62 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 122.313 1.054 . . . . 0.0 109.828 178.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -50.92 -39.1 53.78 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 126.571 1.948 . . . . 0.0 110.841 178.142 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -43.03 98.23 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.393 0.677 . . . . 0.0 111.222 178.185 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -68.2 -26.82 65.92 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 124.33 1.052 . . . . 0.0 110.773 -177.467 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.476 ' CZ3' HD23 ' A' ' 17' ' ' LEU . 60.8 t-105 -79.25 -41.18 28.79 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 123.663 0.785 . . . . 0.0 111.81 170.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -58.04 -45.66 86.63 Favored 'General case' 0 N--CA 1.462 0.132 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 178.167 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -46.17 -46.43 17.37 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 125.209 1.404 . . . . 0.0 112.363 173.371 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 11.4 t80 -55.64 -54.62 41.99 Favored 'General case' 0 N--CA 1.453 -0.322 0 O-C-N 123.574 0.546 . . . . 0.0 110.293 -174.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 43.9 t -75.63 -27.85 58.58 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.278 1.031 . . . . 0.0 111.136 -179.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.72 -24.92 67.97 Favored 'General case' 0 N--CA 1.457 -0.12 0 C-N-CA 123.809 0.844 . . . . 0.0 110.422 175.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -82.21 68.15 8.5 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 122.902 1.334 . . . . 0.0 110.557 -178.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 17.4 t 54.83 32.11 17.0 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 125.812 1.645 . . . . 0.0 114.407 178.253 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 40.5 mtmt 44.63 58.19 4.04 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 123.865 0.866 . . . . 0.0 108.812 -168.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -44.46 152.32 0.21 Allowed 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 157.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -44.63 121.98 2.92 Favored 'General case' 0 N--CA 1.439 -1.009 0 C-N-CA 127.161 2.185 . . . . 0.0 113.01 -163.471 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 49.0 mt -138.43 111.41 7.81 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 105.157 -2.164 . . . . 0.0 105.157 169.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -121.1 164.44 16.82 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 123.584 0.754 . . . . 0.0 109.81 -178.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.428 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 13.3 m-85 -60.34 138.64 57.93 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 176.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 84.2 9.12 82.67 Favored Glycine 0 CA--C 1.524 0.614 0 CA-C-O 119.106 -0.83 . . . . 0.0 113.496 174.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.404 ' HB3' HD11 ' A' ' 17' ' ' LEU . 2.2 m-20 -65.46 -25.88 67.7 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 119.41 1.605 . . . . 0.0 112.485 -171.637 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 19.9 ttmt 75.12 145.5 0.08 Allowed 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 129.523 3.129 . . . . 0.0 112.421 175.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 9.4 tp -135.57 157.86 45.82 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 107.521 -1.288 . . . . 0.0 107.521 171.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 24.2 t -134.45 141.89 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.74 0 C-N-CA 127.456 2.302 . . . . 0.0 106.27 167.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -104.11 176.65 5.08 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.897 1.279 . . . . 0.0 112.067 167.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -69.54 -5.41 24.08 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 -179.581 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.449 HD21 ' CG1' ' A' ' 12' ' ' ILE . 70.3 m-80 -89.87 -1.27 57.95 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 119.412 1.005 . . . . 0.0 111.252 170.016 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 70.13 18.97 6.88 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 127.08 2.152 . . . . 0.0 110.959 -171.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 23.4 m170 -66.88 117.24 8.71 Favored 'General case' 0 C--N 1.34 0.164 0 O-C-N 120.801 -1.187 . . . . 0.0 108.891 169.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 72.6 m -83.11 156.32 23.35 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 118.997 0.817 . . . . 0.0 110.11 169.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -144.71 158.45 43.78 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 125.968 1.707 . . . . 0.0 109.313 177.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 24.4 t -115.86 162.73 13.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 C-N-CA 127.885 2.474 . . . . 0.0 106.907 169.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.52 HD12 ' O ' ' A' ' 66' ' ' HIS . 29.2 tp -111.82 133.45 54.02 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 166.328 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 62.1 mp0 -113.58 -172.8 2.14 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.742 2.017 . . . . 0.0 109.807 -171.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.428 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 2.5 mp0 -77.06 -18.31 58.15 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 120.734 -1.229 . . . . 0.0 113.3 178.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -75.25 -7.98 55.36 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 127.502 2.321 . . . . 0.0 113.444 -168.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 64.34 17.1 10.57 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 129.158 2.983 . . . . 0.0 114.376 -161.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.52 ' O ' HD12 ' A' ' 61' ' ' LEU . 1.1 p-80 -93.94 162.4 13.91 Favored 'General case' 0 C--N 1.34 0.195 0 C-N-CA 125.881 1.672 . . . . 0.0 114.336 164.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.415 ' NE1' HD13 ' A' ' 61' ' ' LEU . 62.0 m95 -106.58 106.41 16.92 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 106.644 -1.613 . . . . 0.0 106.644 164.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.406 ' CG ' ' HD2' ' A' ' 69' ' ' PRO . 0.1 OUTLIER -87.13 156.37 54.62 Favored Pre-proline 0 CA--C 1.545 0.773 0 C-N-CA 123.484 0.713 . . . . 0.0 109.104 175.083 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.406 ' HD2' ' CG ' ' A' ' 68' ' ' HIS . 66.9 Cg_endo -79.78 156.21 24.03 Favored 'Trans proline' 0 N--CA 1.455 -0.759 0 C-N-CA 122.303 2.002 . . . . 0.0 111.989 -172.151 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -132.25 31.91 4.04 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.056 1.342 . . . . 0.0 110.991 -177.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 71.72 165.42 0.13 Allowed Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 128.115 2.566 . . . . 0.0 111.802 179.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -71.43 -179.18 3.43 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 121.677 1.585 . . . . 0.0 109.927 169.226 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 12.8 tp -133.68 150.89 76.02 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-O 118.56 -0.733 . . . . 0.0 111.699 -174.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -61.97 159.47 33.81 Favored 'Trans proline' 0 CA--C 1.536 0.589 0 C-N-CA 122.178 1.919 . . . . 0.0 111.173 166.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -67.88 -38.06 14.17 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 122.329 2.019 . . . . 0.0 111.245 -178.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -72.86 -11.02 60.43 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 124.162 0.985 . . . . 0.0 110.569 175.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -68.78 -28.5 73.05 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-O 118.934 -0.926 . . . . 0.0 111.416 171.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 46.5 tp -62.88 -54.15 43.18 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 118.523 1.161 . . . . 0.0 108.728 170.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -50.24 -43.92 53.17 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.588 1.155 . . . . 0.0 111.661 177.36 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -60.78 -36.82 79.94 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 126.099 1.76 . . . . 0.0 112.724 177.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.423 HD13 ' HA ' ' A' ' 81' ' ' LEU . 1.2 mm? -72.22 -54.4 9.72 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 119.181 0.9 . . . . 0.0 109.84 172.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.406 ' HA ' ' CD1' ' A' ' 25' ' ' LEU . 4.4 mm -50.01 -37.82 13.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 126.372 1.869 . . . . 0.0 110.553 -177.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.01 -40.62 6.66 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 125.687 1.595 . . . . 0.0 112.661 176.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.417 ' HB1' ' HB3' ' A' ' 23' ' ' ASN . . . -60.34 -58.36 8.86 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 119.573 1.078 . . . . 0.0 111.581 178.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -58.82 -45.48 89.88 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 124.166 0.986 . . . . 0.0 109.383 -179.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 96.0 m -73.32 -17.18 61.33 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 120.641 -1.287 . . . . 0.0 112.774 -176.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -84.47 -20.62 31.42 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 119.396 0.998 . . . . 0.0 112.17 173.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.4 t -100.87 -17.35 16.89 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.37 0.532 . . . . 0.0 111.009 -178.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 52.2 mt -102.18 2.83 37.74 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.973 1.309 . . . . 0.0 111.166 165.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 66.59 15.4 64.0 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 125.187 1.375 . . . . 0.0 115.692 171.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 37.4 m-70 -80.08 -35.13 37.39 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 119.5 1.65 . . . . 0.0 112.648 -174.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 68.0 m 47.54 -172.4 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 124.859 1.264 . . . . 0.0 113.479 -166.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 7.4 p -97.62 160.41 14.33 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 124.641 1.176 . . . . 0.0 111.4 -177.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 4.3 t 174.97 161.54 0.22 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 129.203 3.001 . . . . 0.0 105.703 -179.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 63.92 109.96 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.382 1.873 . . . . 0.0 112.454 171.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.6 ttpm? 55.41 52.78 10.78 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.352 1.061 . . . . 0.0 111.03 171.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 8.6 ttp 48.37 43.6 19.53 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.474 1.91 . . . . 0.0 112.564 -174.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 74.91 -58.53 0.57 Allowed 'General case' 0 C--N 1.34 0.195 0 C-N-CA 125.752 1.621 . . . . 0.0 111.176 -170.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 91.4 mt -155.08 121.87 5.42 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 126.259 1.824 . . . . 0.0 107.351 -155.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 32.1 t-80 -67.88 -37.1 81.36 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 117.889 0.313 . . . . 0.0 111.371 171.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 4.7 t -158.92 176.12 12.71 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.781 0.832 . . . . 0.0 111.477 -171.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 79.0 t -55.77 -36.9 44.85 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 C-N-CA 124.19 0.996 . . . . 0.0 108.988 167.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 26.0 tpp -60.01 -39.6 86.37 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.611 0.764 . . . . 0.0 112.311 178.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -61.28 -52.77 63.35 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 176.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.77 -41.7 70.82 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 125.005 1.322 . . . . 0.0 112.338 -171.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 22.4 mm -56.73 -46.89 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.266 0 CA-C-N 120.03 1.286 . . . . 0.0 111.127 -177.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -79.83 -36.89 36.18 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 118.164 0.438 . . . . 0.0 110.194 -178.27 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -59.77 -51.6 69.06 Favored 'General case' 0 C--N 1.337 0.056 0 C-N-CA 125.09 1.356 . . . . 0.0 110.978 -178.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 95.8 mt -68.06 -31.27 70.79 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 125.083 1.353 . . . . 0.0 110.902 -177.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -65.99 -40.15 90.93 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-O 118.894 -0.574 . . . . 0.0 110.8 175.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -75.07 0.68 15.25 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.583 1.153 . . . . 0.0 113.071 -179.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 45.4 mt -80.39 -28.09 38.0 Favored 'General case' 0 N--CA 1.457 -0.109 0 CA-C-N 118.95 0.795 . . . . 0.0 110.488 166.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -81.6 164.91 21.55 Favored 'General case' 0 C--O 1.24 0.563 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 166.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.163 0 N-CA-C 106.8 -2.52 . . . . 0.0 106.8 -164.05 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.4 mtp . . . . . 0 N--CA 1.477 0.908 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 128.51 -57.77 0.71 Allowed Glycine 0 CA--C 1.522 0.495 0 N-CA-C 109.243 -1.543 . . . . 0.0 109.243 -176.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 48.53 -154.64 0.09 Allowed 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.199 1.4 . . . . 0.0 111.709 -176.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 91.47 -117.46 5.21 Favored Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 106.81 -2.516 . . . . 0.0 106.81 -162.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -96.64 10.87 37.29 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.771 1.628 . . . . 0.0 112.895 -161.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.7 p -83.99 160.1 58.61 Favored Pre-proline 0 CA--C 1.537 0.479 0 C-N-CA 125.145 1.378 . . . . 0.0 110.546 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -67.88 -55.0 0.29 Allowed 'Trans proline' 0 N--CA 1.459 -0.5 0 C-N-CA 122.467 2.111 . . . . 0.0 111.267 -169.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -135.75 144.29 48.23 Favored Pre-proline 0 C--O 1.238 0.482 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 176.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -77.4 -17.75 14.43 Favored 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 122.394 2.063 . . . . 0.0 111.965 -176.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -81.43 -26.43 35.36 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 117.636 -1.174 . . . . 0.0 111.964 173.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 tt -56.68 133.34 53.85 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.295 0.952 . . . . 0.0 109.823 -171.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.434 ' CG1' HD21 ' A' ' 55' ' ' ASN . 46.7 mm -112.71 116.37 52.4 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.123 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 -175.051 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 76.5 m95 -60.52 154.35 55.71 Favored Pre-proline 0 N--CA 1.45 -0.444 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.64 176.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -72.15 162.94 88.84 Favored 'Cis proline' 0 N--CA 1.458 -0.597 0 C-N-CA 124.853 -0.895 . . . . 0.0 112.684 -3.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -131.96 166.53 21.48 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 121.773 0.797 . . . . 0.0 110.966 179.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 38.6 mt -138.26 106.5 5.77 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 124.917 1.287 . . . . 0.0 108.813 -170.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.2 tp -84.67 148.79 26.23 Favored 'General case' 0 C--O 1.236 0.395 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 171.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -142.54 96.67 2.98 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 119.612 1.097 . . . . 0.0 108.592 167.135 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -55.15 151.57 9.14 Favored 'General case' 0 C--O 1.24 0.575 0 O-C-N 124.628 1.205 . . . . 0.0 112.425 -164.495 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -71.02 88.56 0.77 Allowed 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.512 0.672 . . . . 0.0 110.967 -177.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 137.15 -34.3 2.21 Favored Glycine 0 CA--C 1.524 0.633 0 C-N-CA 126.251 1.881 . . . . 0.0 110.618 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 85.3 m -76.86 177.07 7.96 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 122.89 1.329 . . . . 0.0 111.257 -178.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -128.82 -35.25 1.89 Allowed 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 126.712 2.005 . . . . 0.0 109.216 -175.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -59.69 131.71 51.76 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.231 1.412 . . . . 0.0 107.856 169.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.424 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -84.17 150.73 25.31 Favored 'General case' 0 CA--C 1.515 -0.393 0 C-N-CA 124.351 1.061 . . . . 0.0 108.678 164.232 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.424 HD22 ' HA ' ' A' ' 26' ' ' LEU . 0.2 OUTLIER -103.68 88.64 1.89 Allowed Pre-proline 0 C--N 1.327 -0.403 0 C-N-CA 128.294 2.637 . . . . 0.0 107.549 176.277 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -56.89 127.13 24.59 Favored 'Trans proline' 0 N--CA 1.45 -1.037 0 N-CA-C 108.988 -1.197 . . . . 0.0 108.988 169.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -118.22 103.54 9.94 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 106.089 -1.819 . . . . 0.0 106.089 166.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 67.8 mtt85 -56.74 -42.51 79.41 Favored 'General case' 0 CA--C 1.519 -0.213 0 O-C-N 122.279 -0.263 . . . . 0.0 110.562 174.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.429 HG23 ' H ' ' A' ' 32' ' ' ASP . 5.0 t -157.49 -177.47 6.62 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 118.344 0.52 . . . . 0.0 110.782 -177.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -51.95 -42.37 62.8 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 125.411 1.485 . . . . 0.0 110.695 174.256 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.429 ' H ' HG23 ' A' ' 30' ' ' THR . 22.0 t70 -54.44 -50.77 66.87 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-N 118.713 0.688 . . . . 0.0 110.639 175.627 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -57.2 -45.6 83.64 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.217 1.407 . . . . 0.0 110.368 178.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 39.6 t-105 -58.3 -40.93 83.31 Favored 'General case' 0 C--N 1.34 0.18 0 C-N-CA 123.8 0.84 . . . . 0.0 111.274 176.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.91 -45.25 90.76 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 178.472 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 8.4 mtt180 -62.6 -32.08 73.02 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 124.056 0.943 . . . . 0.0 111.531 -168.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -49.63 -61.19 2.25 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 125.052 1.341 . . . . 0.0 109.745 171.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 34.6 t -69.23 -35.84 76.59 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -175.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.6 -24.07 67.65 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.782 0.833 . . . . 0.0 110.938 -177.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -78.48 6.01 9.48 Favored 'General case' 0 C--N 1.342 0.267 0 N-CA-C 113.507 0.929 . . . . 0.0 113.507 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 71.13 8.12 6.35 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.823 1.249 . . . . 0.0 111.355 -170.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 49.8 mmtt -94.73 38.24 1.12 Allowed 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 125.623 1.569 . . . . 0.0 110.35 -177.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -74.99 32.03 0.1 Allowed 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 114.31 1.226 . . . . 0.0 114.31 -175.408 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.61 103.54 1.1 Allowed 'General case' 0 N--CA 1.443 -0.807 0 C-N-CA 125.897 1.679 . . . . 0.0 108.593 -177.238 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 72.3 mt -126.73 147.8 49.94 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 -175.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -158.91 131.14 6.7 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 104.652 -2.351 . . . . 0.0 104.652 -167.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.717 ' HA ' HD13 ' A' ' 61' ' ' LEU . 52.8 m-85 -60.07 144.08 50.46 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 -176.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.11 8.28 66.94 Favored Glycine 0 N--CA 1.443 -0.848 0 CA-C-O 118.292 -1.282 . . . . 0.0 114.812 -179.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.47 -9.76 14.31 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.542 1.937 . . . . 0.0 115.207 -174.029 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 15.8 ttmt 51.09 135.55 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.08 1 C-N-CA 132.025 4.13 . . . . 0.0 115.66 174.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 11.5 mt -129.38 157.57 41.58 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 121.088 -1.007 . . . . 0.0 109.568 174.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 37.4 t -135.26 141.35 42.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 127.476 2.31 . . . . 0.0 106.026 173.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -118.1 179.63 4.04 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.803 1.641 . . . . 0.0 111.781 172.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 98.5 p -61.12 -27.3 68.28 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.876 1.271 . . . . 0.0 113.653 -175.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.434 HD21 ' CG1' ' A' ' 12' ' ' ILE . 14.1 m-80 -82.73 1.22 39.84 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 125.64 1.576 . . . . 0.0 110.745 178.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 61.3 23.73 13.92 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.542 1.537 . . . . 0.0 110.405 -170.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 27.8 m170 -61.08 124.04 19.39 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 120.699 1.59 . . . . 0.0 107.515 164.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.498 ' HB3' ' HB3' ' A' ' 70' ' ' ALA . 0.7 OUTLIER -88.5 145.85 25.51 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 107.138 -1.431 . . . . 0.0 107.138 166.785 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -135.99 155.69 49.87 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.192 0.997 . . . . 0.0 109.028 174.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 40.0 t -141.62 131.63 25.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 C-N-CA 128.046 2.538 . . . . 0.0 107.074 -177.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.717 HD13 ' HA ' ' A' ' 47' ' ' TYR . 0.2 OUTLIER -74.55 123.33 24.6 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 107.159 -1.422 . . . . 0.0 107.159 169.436 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -110.54 167.31 10.31 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.225 0.921 . . . . 0.0 109.438 173.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -59.54 -4.16 0.58 Allowed 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.848 1.259 . . . . 0.0 113.643 178.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -77.87 -2.73 38.11 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 120.606 -1.309 . . . . 0.0 111.755 167.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 70.68 -3.0 2.06 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 126.613 1.965 . . . . 0.0 112.286 -178.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -89.1 166.17 14.03 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 123.604 0.762 . . . . 0.0 110.737 175.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 68.5 m95 -107.35 97.41 7.17 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 125.616 1.567 . . . . 0.0 107.012 173.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 54.9 t-80 -79.81 145.09 61.28 Favored Pre-proline 0 CA--C 1.543 0.705 0 CA-C-O 118.122 -0.942 . . . . 0.0 110.222 -175.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -68.47 109.0 1.94 Allowed 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 124.166 3.244 . . . . 0.0 112.5 172.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.498 ' HB3' ' HB3' ' A' ' 58' ' ' CYS . . . -80.0 21.05 0.59 Allowed 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.287 1.435 . . . . 0.0 111.858 170.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 67.17 165.85 0.12 Allowed Pre-proline 0 C--O 1.237 0.434 0 C-N-CA 127.3 2.24 . . . . 0.0 111.817 -176.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -65.05 163.9 26.99 Favored 'Trans proline' 0 N--CA 1.447 -1.23 0 C-N-CA 120.81 1.007 . . . . 0.0 112.39 174.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 15.8 tp -118.95 146.75 40.95 Favored Pre-proline 0 CA--C 1.535 0.39 0 C-N-CA 126.279 1.832 . . . . 0.0 110.102 -173.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.49 164.35 31.23 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 122.278 1.985 . . . . 0.0 111.523 173.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -59.02 -33.54 98.77 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.843 2.362 . . . . 0.0 112.353 178.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -77.58 -24.71 49.7 Favored 'General case' 0 N--CA 1.454 -0.239 0 O-C-N 121.697 -0.627 . . . . 0.0 111.239 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -64.43 -29.13 74.25 Favored Glycine 0 CA--C 1.532 1.127 0 CA-C-N 118.4 0.545 . . . . 0.0 112.396 -174.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 37.5 tp -55.73 -53.0 61.98 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 124.871 1.268 . . . . 0.0 109.638 169.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -64.25 -25.78 68.21 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.255 0.622 . . . . 0.0 111.3 -173.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -72.26 -20.41 61.53 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.761 0.824 . . . . 0.0 112.521 177.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 67.1 mt -83.17 -50.22 8.67 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 118.924 0.784 . . . . 0.0 109.026 168.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.8 mm -50.87 -40.28 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 126.094 1.758 . . . . 0.0 111.655 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.82 -41.81 7.33 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 125.104 1.362 . . . . 0.0 110.751 176.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -73.78 -44.77 55.02 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -178.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.424 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 5.6 t60 -62.87 -45.06 94.32 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 119.682 1.128 . . . . 0.0 108.843 177.526 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 91.9 m -62.69 -41.05 98.92 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.484 177.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.69 -33.31 73.74 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -178.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 9.2 t -74.4 -38.89 62.98 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.971 0.805 . . . . 0.0 109.042 -177.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 78.4 mt -87.41 -52.11 5.55 Favored 'General case' 0 N--CA 1.462 0.166 0 O-C-N 121.659 -0.651 . . . . 0.0 109.772 -173.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 115.98 58.06 0.33 Allowed Glycine 0 CA--C 1.523 0.535 0 C-N-CA 125.971 1.748 . . . . 0.0 108.918 -179.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . 0.753 ' CD2' HD13 ' A' ' 112' ' ' LEU . 13.3 m-70 -115.32 164.61 14.0 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 123.777 0.831 . . . . 0.0 110.895 -175.65 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 64.2 m -114.51 -164.9 0.97 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.795 1.238 . . . . 0.0 111.106 -170.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 1.2 p -129.42 103.54 6.97 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 125.068 1.347 . . . . 0.0 109.348 -163.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 8.3 t -80.8 74.34 7.76 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 127.006 2.122 . . . . 0.0 109.257 -175.756 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 27.1 t 64.89 172.38 0.2 Allowed 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.303 1.441 . . . . 0.0 111.508 -177.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.409 ' HE3' ' CD2' ' A' ' 100' ' ' HIS . 2.4 mptp? 48.49 -164.31 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.524 1.13 . . . . 0.0 109.691 -158.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 7.4 mtm -68.21 -16.52 64.01 Favored 'General case' 0 N--CA 1.463 0.214 0 O-C-N 120.999 -1.063 . . . . 0.0 112.817 177.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -168.43 -50.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 126.94 2.096 . . . . 0.0 110.463 -178.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.418 HD13 ' HB2' ' A' ' 105' ' ' ALA . 89.7 mt -154.3 163.38 40.23 Favored 'General case' 0 CA--C 1.514 -0.433 0 C-N-CA 127.119 2.168 . . . . 0.0 109.88 -170.427 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . 0.409 ' CD2' ' HE3' ' A' ' 96' ' ' LYS . 16.0 t-160 -86.56 -37.39 18.2 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 123.692 0.797 . . . . 0.0 112.644 169.063 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 4.5 t -172.41 -178.92 2.11 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 118.582 0.628 . . . . 0.0 112.684 -165.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 45.2 t -68.05 -39.82 82.11 Favored 'Isoleucine or valine' 0 C--N 1.345 0.371 0 C-N-CA 124.048 0.939 . . . . 0.0 111.194 -179.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -59.89 -44.89 93.98 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 177.599 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.55 -49.71 67.09 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 127.388 2.275 . . . . 0.0 109.968 174.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.418 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -59.21 -56.29 24.0 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 124.924 1.29 . . . . 0.0 111.28 179.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 3.4 mm -60.17 -41.07 85.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -174.106 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -59.98 -50.05 75.27 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 124.032 0.933 . . . . 0.0 110.25 176.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.704 ' CE2' HD11 ' A' ' 112' ' ' LEU . 48.4 t80 -54.5 -67.46 0.26 Allowed 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 126.666 1.986 . . . . 0.0 110.022 178.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.54 ' HA ' HD12 ' A' ' 112' ' ' LEU . 6.9 mp -47.48 -49.95 24.44 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 125.266 1.426 . . . . 0.0 111.681 179.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 63.3 m-80 -79.44 -4.79 52.77 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -176.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -99.15 -25.59 14.48 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 119.559 1.072 . . . . 0.0 111.169 169.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.753 HD13 ' CD2' ' A' ' 91' ' ' HIS . 40.3 mt -62.8 -60.28 3.71 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 174.514 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -72.54 154.11 40.98 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 123.96 0.788 . . . . 0.0 111.349 -169.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.106 0 N-CA-C 106.864 -2.494 . . . . 0.0 106.864 -176.72 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.4 ptp . . . . . 0 N--CA 1.473 0.694 0 CA-C-O 119.78 -0.152 . . . . 0.0 110.814 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 64.96 -172.0 21.62 Favored Glycine 0 CA--C 1.537 1.46 0 O-C-N 121.786 -0.571 . . . . 0.0 113.403 176.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -50.73 129.34 22.71 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 126.815 2.046 . . . . 0.0 111.568 -171.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 137.89 -72.06 0.45 Allowed Glycine 0 CA--C 1.519 0.289 0 N-CA-C 108.742 -1.743 . . . . 0.0 108.742 -164.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -84.5 9.72 12.76 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 27.2 p -122.86 151.01 60.21 Favored Pre-proline 0 C--O 1.238 0.457 0 C-N-CA 124.065 0.946 . . . . 0.0 111.717 -176.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -74.53 95.66 0.95 Allowed 'Trans proline' 0 N--CA 1.45 -1.08 0 C-N-CA 123.244 2.63 . . . . 0.0 109.487 178.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 75.6 144.51 0.1 Allowed Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 128.294 2.638 . . . . 0.0 113.964 176.138 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -80.03 -20.56 8.69 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 122.877 2.385 . . . . 0.0 114.201 -178.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -78.12 -18.59 55.46 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 117.295 -1.336 . . . . 0.0 111.527 172.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 tt -60.89 127.0 29.44 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 121.276 1.853 . . . . 0.0 110.831 -174.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 44.6 mm -111.73 118.59 57.96 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.096 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 178.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 63.7 m95 -64.53 152.85 88.47 Favored Pre-proline 0 C--O 1.237 0.411 0 CA-C-O 118.53 -0.748 . . . . 0.0 110.5 173.355 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -70.17 160.2 89.66 Favored 'Cis proline' 0 N--CA 1.458 -0.593 0 C-N-CA 124.697 -0.96 . . . . 0.0 113.717 -1.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -119.6 168.36 11.1 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.972 0.909 . . . . 0.0 109.687 174.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 16.0 mt -140.25 91.25 2.43 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.885 2.074 . . . . 0.0 107.1 -179.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 26.8 tp -68.34 144.86 54.64 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 106.234 -1.765 . . . . 0.0 106.234 160.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -143.11 95.64 2.8 Favored 'General case' 0 CA--C 1.506 -0.743 0 N-CA-C 103.776 -2.675 . . . . 0.0 103.776 167.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.482 HE22 ' HB3' ' A' ' 44' ' ' LEU . 8.1 mt-30 -55.06 137.43 46.47 Favored 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 124.717 1.261 . . . . 0.0 109.861 -167.637 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.8 134.33 56.59 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-O 122.449 1.119 . . . . 0.0 109.051 175.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 97.73 -45.69 1.7 Allowed Glycine 0 CA--C 1.526 0.741 0 C-N-CA 126.251 1.881 . . . . 0.0 111.446 -172.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 66.3 m -68.44 165.59 18.57 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 118.216 1.008 . . . . 0.0 109.983 174.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.559 ' HB3' ' HB1' ' A' ' 84' ' ' ALA . 0.9 OUTLIER -116.48 -29.3 6.2 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.407 1.483 . . . . 0.0 108.267 173.931 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -64.98 144.98 56.93 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 127.426 2.29 . . . . 0.0 109.738 174.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.1 mt -99.98 161.43 13.61 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 125.885 1.674 . . . . 0.0 110.152 -176.289 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -115.05 85.96 13.0 Favored Pre-proline 0 C--O 1.236 0.345 0 C-N-CA 125.201 1.4 . . . . 0.0 108.622 164.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -65.88 135.22 40.33 Favored 'Trans proline' 0 N--CA 1.453 -0.905 0 C-N-CA 121.987 1.791 . . . . 0.0 108.502 168.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.5 mt -134.2 100.45 4.7 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 -177.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.6 mtt180 -58.92 -47.39 85.18 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.144 0.497 . . . . 0.0 111.175 -168.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 66.3 p -141.87 175.98 9.29 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -172.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -54.13 -36.48 63.32 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-O 119.132 -0.461 . . . . 0.0 110.446 166.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -67.38 -16.77 64.43 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -174.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -80.95 -43.93 18.99 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.345 1.058 . . . . 0.0 109.647 171.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 76.4 t-105 -64.89 -37.82 88.91 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.144 0.978 . . . . 0.0 111.877 176.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.9 mm100 -52.61 -48.47 66.31 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 124.666 1.187 . . . . 0.0 109.055 177.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 45.4 mtp85 -61.94 -31.69 72.04 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 124.839 1.256 . . . . 0.0 112.236 179.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -73.79 -54.22 8.52 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.262 0.625 . . . . 0.0 109.806 -178.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 23.8 t -65.57 -24.02 66.99 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.545 0.738 . . . . 0.0 112.276 176.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.93 -46.73 70.68 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.365 1.066 . . . . 0.0 109.985 172.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -114.66 73.3 0.82 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-O 122.252 1.025 . . . . 0.0 111.253 -157.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 36.8 m 70.97 107.5 0.06 Allowed 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 127.008 2.123 . . . . 0.0 110.383 177.134 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.3 -17.75 0.17 Allowed 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 127.51 2.324 . . . . 0.0 116.864 -173.325 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 73.92 -170.04 0.11 Allowed 'General case' 0 C--O 1.238 0.488 0 C-N-CA 125.379 1.472 . . . . 0.0 113.437 164.701 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.482 ' HB3' HE22 ' A' ' 19' ' ' GLN . 4.8 mt -70.29 123.62 22.15 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 106.838 -1.541 . . . . 0.0 106.838 174.327 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 93.5 mt -139.71 143.58 37.12 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 105.63 -1.989 . . . . 0.0 105.63 171.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 26.3 pt20 -157.6 130.33 7.45 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 104.628 -2.36 . . . . 0.0 104.628 -173.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -56.87 132.53 52.79 Favored 'General case' 0 C--O 1.243 0.733 0 N-CA-C 105.554 -2.017 . . . . 0.0 105.554 175.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 100.76 -0.25 55.29 Favored Glycine 0 CA--C 1.534 1.264 0 CA-C-O 118.989 -0.895 . . . . 0.0 115.239 -176.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.58 -19.87 28.59 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 119.874 1.837 . . . . 0.0 115.282 -174.214 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt 62.13 136.37 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 129.786 3.234 . . . . 0.0 113.718 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 8.4 tp -126.76 153.0 46.13 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 174.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 27.5 t -132.67 128.83 57.99 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 N-CA-C 103.783 -2.673 . . . . 0.0 103.783 172.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -97.23 177.76 5.46 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 122.06 0.933 . . . . 0.0 110.748 168.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.1 t -60.65 -19.88 59.37 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.162 1.385 . . . . 0.0 112.763 -178.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -84.32 -14.08 50.66 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 120.535 1.516 . . . . 0.0 113.084 -176.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 67.85 41.65 2.1 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 118.853 0.751 . . . . 0.0 109.72 -158.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 31.6 m170 -91.78 127.64 37.32 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 154.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -90.07 159.44 16.82 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 173.04 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -144.48 161.02 40.11 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 123.43 0.692 . . . . 0.0 110.539 177.301 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 25.7 t -139.07 131.05 36.33 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 128.096 2.558 . . . . 0.0 106.881 177.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.07 130.67 38.69 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 105.936 -1.875 . . . . 0.0 105.936 171.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -123.27 166.83 14.6 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.194 1.397 . . . . 0.0 109.692 177.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -57.74 -27.91 63.42 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 119.861 -1.774 . . . . 0.0 114.86 -166.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -75.39 15.11 0.49 Allowed 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 128.803 2.841 . . . . 0.0 112.369 177.003 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 68.7 9.23 7.22 Favored 'General case' 0 C--N 1.355 0.825 0 C-N-CA 125.61 1.564 . . . . 0.0 113.231 167.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 3.3 p-80 -101.31 159.48 15.23 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 122.386 1.089 . . . . 0.0 111.396 172.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 82.2 m95 -97.49 97.75 9.35 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 105.867 -1.901 . . . . 0.0 105.867 168.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 38.5 t-80 -71.28 143.77 88.63 Favored Pre-proline 0 CA--C 1.538 0.511 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 175.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -68.38 105.83 1.31 Allowed 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.314 2.676 . . . . 0.0 108.97 173.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.67 43.74 0.69 Allowed 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 126.03 1.732 . . . . 0.0 110.892 -176.029 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.531 ' HB1' ' HD2' ' A' ' 72' ' ' PRO . . . 60.73 166.47 0.09 OUTLIER Pre-proline 0 CA--C 1.542 0.637 0 C-N-CA 125.666 1.586 . . . . 0.0 111.942 -167.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.531 ' HD2' ' HB1' ' A' ' 71' ' ' ALA . 57.6 Cg_endo -64.13 177.42 1.99 Allowed 'Trans proline' 0 N--CA 1.451 -1.002 0 C-N-CA 121.122 1.215 . . . . 0.0 111.977 168.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 6.0 tt -122.61 143.46 39.96 Favored Pre-proline 0 CA--C 1.534 0.347 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -79.73 165.27 22.59 Favored 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 122.085 1.857 . . . . 0.0 110.662 -175.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -65.17 -15.63 51.17 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 121.689 1.593 . . . . 0.0 113.248 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -89.32 -27.36 20.57 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.965 0.906 . . . . 0.0 112.925 172.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.54 -36.43 89.36 Favored Glycine 0 C--N 1.344 1.003 0 C-N-CA 124.738 1.161 . . . . 0.0 112.404 -166.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.0 tp -57.61 -48.24 79.96 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 125.687 1.595 . . . . 0.0 108.445 -178.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -62.29 -25.77 68.04 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 118.137 -0.935 . . . . 0.0 112.574 -173.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -72.61 -37.05 68.19 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.486 1.039 . . . . 0.0 111.551 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.4 mp -65.27 -49.98 67.51 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.837 0.855 . . . . 0.0 110.321 173.143 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 15.4 mm -52.19 -42.59 36.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 125.228 1.411 . . . . 0.0 109.178 174.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.4 ttt-85 -52.66 -18.04 1.6 Allowed 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 126.919 2.088 . . . . 0.0 114.61 175.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.559 ' HB1' ' HB3' ' A' ' 23' ' ' ASN . . . -90.1 -51.68 5.34 Favored 'General case' 0 CA--C 1.527 0.079 0 CA-C-N 120.235 1.379 . . . . 0.0 110.859 176.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -57.59 -48.15 80.19 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 121.958 0.885 . . . . 0.0 110.317 175.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 90.3 m -66.86 -36.66 82.82 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 121.52 -0.737 . . . . 0.0 110.877 -177.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.53 -46.72 84.7 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 118.521 0.601 . . . . 0.0 111.176 175.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.5 t -68.55 -31.44 70.66 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -172.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 91.0 mt -79.87 -57.44 3.65 Favored 'General case' 0 N--CA 1.463 0.185 0 O-C-N 121.06 -1.025 . . . . 0.0 110.619 176.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 127.25 39.66 0.37 Allowed Glycine 0 CA--C 1.533 1.18 0 C-N-CA 125.756 1.646 . . . . 0.0 112.853 -177.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 65.8 m-70 -120.27 169.21 10.48 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 119.21 1.505 . . . . 0.0 110.511 -177.185 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 8.0 t -150.73 170.41 19.3 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.27 1.028 . . . . 0.0 110.874 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 92.0 m -58.17 153.51 14.83 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 127.441 2.296 . . . . 0.0 111.852 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -116.72 -85.75 0.63 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.677 1.591 . . . . 0.0 107.971 -173.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -140.66 -174.19 3.9 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 126.97 2.108 . . . . 0.0 108.179 179.411 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 30.2 tptt 48.68 54.59 10.39 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 125.705 1.602 . . . . 0.0 112.624 171.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 6.8 tpt 53.92 37.14 25.98 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.657 0.783 . . . . 0.0 110.561 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 62.69 -61.83 0.12 Allowed 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 126.62 1.968 . . . . 0.0 111.458 -160.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 97.7 mt -135.42 116.9 14.76 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 125.231 1.412 . . . . 0.0 109.169 -156.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 10.6 t-80 -75.19 -26.31 58.91 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 172.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 79.1 p -159.21 172.98 17.07 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 119.481 1.037 . . . . 0.0 112.015 177.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 47.5 t -58.14 -43.46 85.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.261 166.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 1.2 ttm -55.85 -50.04 71.68 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 118.995 0.816 . . . . 0.0 110.355 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.41 -29.85 69.46 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 120.704 -0.398 . . . . 0.0 110.168 -178.31 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -69.27 -42.77 75.11 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 124.802 1.241 . . . . 0.0 112.823 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 32.7 mm -54.95 -39.86 51.0 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 172.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -69.34 -44.6 71.32 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 119.438 -0.315 . . . . 0.0 111.032 -178.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -57.71 -44.47 85.94 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.257 1.023 . . . . 0.0 111.001 176.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 12.4 mt -54.61 -35.97 63.97 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 124.929 1.292 . . . . 0.0 112.136 173.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -88.58 0.62 56.17 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.438 1.495 . . . . 0.0 112.516 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -112.92 3.52 16.34 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.872 1.669 . . . . 0.0 112.281 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 15.5 mt -76.66 -38.84 53.89 Favored 'General case' 0 CA--C 1.527 0.07 0 C-N-CA 123.439 0.695 . . . . 0.0 109.809 167.074 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -66.75 163.24 19.63 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.805 1.242 . . . . 0.0 110.363 169.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.995 0 CA-C-O 117.488 -1.729 . . . . 0.0 108.827 -174.79 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.9 mmm . . . . . 0 N--CA 1.471 0.595 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 75.87 -117.63 5.18 Favored Glycine 0 C--N 1.333 0.399 0 N-CA-C 110.178 -1.169 . . . . 0.0 110.178 175.05 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -74.04 179.8 4.19 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.654 0.781 . . . . 0.0 111.5 175.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 154.51 -30.55 0.69 Allowed Glycine 0 CA--C 1.522 0.488 0 C-N-CA 125.158 1.361 . . . . 0.0 112.126 167.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 14.8 mt-30 60.01 17.69 6.92 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.329 1.852 . . . . 0.0 113.964 172.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 19.5 p -129.85 163.59 46.08 Favored Pre-proline 0 C--O 1.237 0.411 0 C-N-CA 128.617 2.767 . . . . 0.0 109.19 -176.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -81.9 83.32 2.11 Favored 'Trans proline' 0 N--CA 1.444 -1.44 0 C-N-CA 121.723 1.616 . . . . 0.0 109.172 173.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 74.9 149.33 0.12 Allowed Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 127.706 2.402 . . . . 0.0 111.164 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -73.42 -34.0 6.34 Favored 'Trans proline' 0 CA--C 1.534 0.497 0 C-N-CA 122.007 1.804 . . . . 0.0 112.806 173.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -76.47 -11.89 59.95 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 118.807 0.73 . . . . 0.0 112.892 -171.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 tt -61.2 142.37 56.83 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.302 0.641 . . . . 0.0 110.066 167.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 34.1 mm -124.96 117.77 51.14 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 173.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 81.4 m95 -61.22 151.63 75.25 Favored Pre-proline 0 C--O 1.235 0.323 0 C-N-CA 122.771 0.429 . . . . 0.0 110.779 177.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -73.24 168.14 76.87 Favored 'Cis proline' 0 N--CA 1.457 -0.637 0 C-N-CA 125.122 -0.783 . . . . 0.0 114.027 -1.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -137.06 172.91 12.3 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.332 1.053 . . . . 0.0 110.685 177.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 17.2 mt -141.41 105.97 4.88 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 126.246 1.818 . . . . 0.0 108.681 -171.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 32.5 tp -87.92 150.35 23.53 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 125.262 1.425 . . . . 0.0 109.913 174.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -144.53 83.19 1.71 Allowed 'General case' 0 C--O 1.239 0.501 0 CA-C-N 120.176 1.353 . . . . 0.0 110.391 172.567 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -47.77 140.91 5.99 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 125.889 1.676 . . . . 0.0 113.296 -170.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -62.94 117.52 6.52 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.612 0.72 . . . . 0.0 110.642 -179.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 119.39 -62.21 0.47 Allowed Glycine 0 N--CA 1.451 -0.355 0 N-CA-C 108.575 -1.81 . . . . 0.0 108.575 -170.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -76.1 -179.75 5.16 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 123.434 1.588 . . . . 0.0 112.663 -166.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -124.78 -16.72 6.1 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 126.075 1.75 . . . . 0.0 109.319 176.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -77.47 109.98 11.86 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 -174.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.521 HD12 ' HB2' ' A' ' 85' ' ' HIS . 0.5 OUTLIER -65.65 148.3 51.98 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 119.604 -0.838 . . . . 0.0 108.947 172.419 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -104.34 87.68 1.78 Allowed Pre-proline 0 N--CA 1.447 -0.619 0 C-N-CA 126.314 1.846 . . . . 0.0 106.45 173.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -61.91 132.45 39.73 Favored 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 121.949 1.766 . . . . 0.0 108.526 170.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -118.61 103.28 9.56 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.923 1.289 . . . . 0.0 107.577 174.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 30.0 mtt180 -66.87 -38.99 87.37 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 119.415 1.007 . . . . 0.0 112.754 -169.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 15.5 p -152.55 166.81 30.87 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 126.367 1.867 . . . . 0.0 106.95 -170.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -47.75 -37.85 14.24 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.501 1.046 . . . . 0.0 112.636 175.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.02 -17.9 29.53 Favored 'General case' 0 C--O 1.231 0.095 0 C-N-CA 125.354 1.462 . . . . 0.0 114.275 -177.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -87.09 -47.28 9.04 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.479 1.912 . . . . 0.0 110.274 -175.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 53.4 t-105 -58.21 -34.69 70.67 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 120.659 -1.276 . . . . 0.0 110.267 176.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -51.21 -48.35 62.04 Favored 'General case' 0 C--N 1.341 0.234 0 C-N-CA 123.635 0.774 . . . . 0.0 110.105 173.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 5.2 mtt180 -67.14 -21.88 65.8 Favored 'General case' 0 CA--C 1.517 -0.322 0 C-N-CA 125.711 1.604 . . . . 0.0 112.225 -169.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -69.52 -68.32 0.42 Allowed 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 69.1 m -67.18 -17.17 64.72 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -175.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.77 -9.46 37.19 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.424 1.09 . . . . 0.0 111.78 170.291 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -122.77 55.76 1.17 Allowed 'General case' 0 C--O 1.233 0.207 0 CA-C-O 122.952 1.358 . . . . 0.0 110.014 172.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.2 t 71.69 160.23 0.22 Allowed 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 128.64 2.776 . . . . 0.0 111.029 -172.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -102.3 46.58 0.92 Allowed 'General case' 0 C--O 1.237 0.399 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 176.151 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -67.07 172.64 4.37 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 107.422 -1.325 . . . . 0.0 107.422 174.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . 0.326 36.9 mt 62.12 -154.98 0.35 Allowed 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.972 0.909 . . . . 0.0 111.952 174.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.521 ' N ' HE21 ' A' ' 46' ' ' GLN . 31.2 mt 75.68 84.51 0.09 Allowed 'General case' 0 C--N 1.34 0.161 0 C-N-CA 125.365 1.466 . . . . 0.0 112.373 163.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.521 HE21 ' N ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -104.11 165.66 10.91 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.301 1.04 . . . . 0.0 111.06 -169.896 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 17.7 m-85 -73.08 79.29 1.23 Allowed 'General case' 0 C--O 1.234 0.264 0 C-N-CA 125.485 1.514 . . . . 0.0 109.711 177.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 150.84 -0.75 0.37 Allowed Glycine 0 N--CA 1.446 -0.696 0 CA-C-N 115.003 -0.999 . . . . 0.0 113.022 -167.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.04 -9.4 38.76 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 119.41 1.605 . . . . 0.0 114.621 -168.172 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt 44.23 126.44 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.785 1 C-N-CA 132.993 4.517 . . . . 0.0 114.837 179.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.0 tp -120.04 151.21 39.34 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 124.283 1.033 . . . . 0.0 108.252 170.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.41 HG11 HD13 ' A' ' 73' ' ' LEU . 33.8 t -134.8 146.27 31.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 105.535 -2.024 . . . . 0.0 105.535 161.496 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -120.95 -171.11 2.13 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 127.782 2.433 . . . . 0.0 110.701 178.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 88.8 p -63.93 -29.17 70.37 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -72.47 -14.72 61.74 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 124.121 0.968 . . . . 0.0 112.305 -178.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.63 ' CD1' HD22 ' A' ' 73' ' ' LEU . 48.3 m-85 51.15 57.33 6.75 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.196 0.999 . . . . 0.0 111.406 -177.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 11.0 m170 -120.75 13.02 11.49 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.377 1.071 . . . . 0.0 113.693 -171.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 57.0 m 43.05 124.99 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.541 1 C-N-CA 133.624 4.77 . . . . 0.0 113.573 176.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -126.54 141.88 51.72 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 121.362 -0.836 . . . . 0.0 109.171 178.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 30.5 t -130.9 146.13 34.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 C-N-CA 127.243 2.217 . . . . 0.0 105.698 169.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 21.4 tp -77.19 139.1 39.81 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 124.184 0.994 . . . . 0.0 108.607 177.104 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -108.0 167.2 10.16 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 125.789 1.636 . . . . 0.0 109.67 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -69.72 -9.85 56.02 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.82 0.848 . . . . 0.0 112.493 176.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.3 t0 -81.78 6.6 15.01 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.562 1.545 . . . . 0.0 111.087 166.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 53.01 8.25 0.09 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 128.053 2.541 . . . . 0.0 114.29 -169.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.2 p-80 -79.26 165.91 22.71 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 119.435 1.016 . . . . 0.0 109.405 169.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 75.6 m95 -102.45 122.31 44.07 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 106.838 -1.541 . . . . 0.0 106.838 170.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 63.0 t60 -98.99 143.68 26.82 Favored Pre-proline 0 CA--C 1.536 0.431 0 CA-C-O 118.379 -0.819 . . . . 0.0 109.186 -176.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -74.52 125.26 9.46 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 124.109 3.206 . . . . 0.0 110.754 173.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -116.72 39.33 3.21 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 125.021 1.328 . . . . 0.0 110.426 -168.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 67.61 164.35 0.13 Allowed Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 127.98 2.512 . . . . 0.0 111.949 -178.162 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -69.7 174.27 9.71 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.201 1.934 . . . . 0.0 114.26 -172.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.63 HD22 ' CD1' ' A' ' 56' ' ' PHE . 8.3 tt -128.75 143.64 49.32 Favored Pre-proline 0 CA--C 1.542 0.652 0 C-N-CA 126.663 1.985 . . . . 0.0 108.411 -175.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.463 ' O ' HD23 ' A' ' 73' ' ' LEU . 73.2 Cg_endo -85.6 165.45 10.57 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 123.14 2.56 . . . . 0.0 112.977 -178.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -60.15 -14.06 26.94 Favored 'Trans proline' 0 CA--C 1.531 0.361 0 C-N-CA 123.383 2.722 . . . . 0.0 114.77 177.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -101.31 -14.24 17.71 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.251 1.82 . . . . 0.0 112.493 177.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -75.22 -25.59 68.25 Favored Glycine 0 CA--C 1.53 1.003 0 O-C-N 121.133 -0.98 . . . . 0.0 112.916 -177.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 23.0 tp -50.75 -48.69 59.07 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 118.359 1.08 . . . . 0.0 109.333 166.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -68.31 -21.45 64.77 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.931 -168.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -69.31 -43.55 73.54 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 120.398 1.454 . . . . 0.0 111.565 172.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -60.34 -55.4 34.15 Favored 'General case' 0 CA--C 1.522 -0.098 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 175.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.8 mm -58.3 -33.28 47.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 123.609 0.763 . . . . 0.0 110.605 -176.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.9 -35.56 45.86 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 119.429 1.013 . . . . 0.0 112.219 175.668 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.26 -61.45 2.35 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 119.212 0.915 . . . . 0.0 109.365 176.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.521 ' HB2' HD12 ' A' ' 25' ' ' LEU . 10.2 t60 -57.98 -36.56 72.78 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.876 0.871 . . . . 0.0 112.194 -175.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 96.7 m -70.39 -54.37 12.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 118.358 -0.83 . . . . 0.0 110.973 175.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.14 -24.99 65.06 Favored 'General case' 0 C--O 1.23 0.074 0 CA-C-N 118.862 0.755 . . . . 0.0 112.03 -171.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.4 t -76.85 -15.37 59.73 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 118.653 -0.689 . . . . 0.0 110.755 178.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.586 HD12 ' CE1' ' A' ' 91' ' ' HIS . 83.6 mt -114.77 -58.28 2.16 Favored 'General case' 0 C--N 1.343 0.324 0 CA-C-N 119.636 1.107 . . . . 0.0 110.6 -174.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 149.36 5.55 0.22 Allowed Glycine 0 CA--C 1.528 0.901 0 CA-C-O 118.93 -0.928 . . . . 0.0 113.9 -173.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . 0.782 ' CE1' HD13 ' A' ' 112' ' ' LEU . 30.3 m170 -76.71 142.29 40.57 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 119.511 1.656 . . . . 0.0 110.74 -161.558 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 24.4 t -139.49 72.29 1.4 Allowed 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 124.229 1.012 . . . . 0.0 109.115 -174.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 96.1 m 60.13 176.91 0.09 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.521 1.929 . . . . 0.0 114.597 173.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 8.8 t -159.75 61.18 0.37 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 128.359 2.663 . . . . 0.0 109.053 -177.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.4 t 68.96 152.47 0.09 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.562 1.145 . . . . 0.0 111.088 179.05 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.8 ttpt 66.97 -177.2 0.2 Allowed 'General case' 0 N--CA 1.469 0.501 0 O-C-N 120.492 -1.38 . . . . 0.0 111.773 -176.039 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 4.6 tpt -73.78 86.5 1.71 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.488 1.515 . . . . 0.0 108.194 175.123 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 1.2 m80 55.8 -76.55 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 127.066 2.146 . . . . 0.0 112.384 -175.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.456 HD13 ' HB2' ' A' ' 105' ' ' ALA . 81.6 mt -147.19 133.67 19.74 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 125.829 1.652 . . . . 0.0 108.102 -173.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 47.1 t-80 -67.6 -42.9 81.72 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 124.294 0.996 . . . . 0.0 111.807 179.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -170.2 -179.2 3.03 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.243 1.417 . . . . 0.0 109.157 -173.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 16.0 t -59.26 -40.62 81.71 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 C-N-CA 123.824 0.85 . . . . 0.0 110.818 -175.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -54.15 -45.67 72.08 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.875 0.87 . . . . 0.0 109.829 178.401 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -63.12 -41.53 99.36 Favored 'General case' 0 C--N 1.333 -0.115 0 C-N-CA 124.746 1.218 . . . . 0.0 110.564 -178.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.456 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -60.56 -50.17 74.63 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 124.224 1.01 . . . . 0.0 111.135 178.392 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 14.0 mm -66.31 -37.09 78.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -174.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -61.91 -47.97 82.54 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 118.763 0.711 . . . . 0.0 110.168 174.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -52.83 -63.7 1.06 Allowed 'General case' 0 C--N 1.342 0.257 0 C-N-CA 125.323 1.449 . . . . 0.0 111.59 179.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.7 mp -51.43 -47.0 63.15 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.702 1.201 . . . . 0.0 110.993 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -73.28 -18.36 61.22 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 121.663 -0.648 . . . . 0.0 112.377 -178.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -85.48 -22.85 28.05 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.357 1.063 . . . . 0.0 111.418 176.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.782 HD13 ' CE1' ' A' ' 91' ' ' HIS . 22.5 mt -69.17 -61.5 1.77 Allowed 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.133 0.973 . . . . 0.0 109.065 172.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -63.18 159.72 17.02 Favored 'General case' 0 C--O 1.24 0.584 0 N-CA-C 114.042 1.127 . . . . 0.0 114.042 -170.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.808 0 CA-C-O 118.321 -1.266 . . . . 0.0 110.985 171.272 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.467 0.42 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 159.34 81.95 0.04 OUTLIER Glycine 0 N--CA 1.445 -0.729 0 N-CA-C 108.554 -1.818 . . . . 0.0 108.554 173.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.2 134.18 56.28 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-N 117.057 0.429 . . . . 0.0 110.54 -172.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 176.17 167.3 34.78 Favored Glycine 0 CA--C 1.521 0.453 0 C-N-CA 125.163 1.363 . . . . 0.0 110.435 178.117 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 60.59 9.48 2.13 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 126.7 2.0 . . . . 0.0 115.073 -177.185 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 10.3 p -64.78 154.56 85.21 Favored Pre-proline 0 C--N 1.321 -0.664 0 C-N-CA 125.066 1.346 . . . . 0.0 110.771 173.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -79.31 90.2 1.29 Allowed 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 123.865 3.043 . . . . 0.0 110.258 -178.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 74.54 144.72 0.11 Allowed Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 127.898 2.479 . . . . 0.0 111.194 -175.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -77.94 -20.41 11.69 Favored 'Trans proline' 0 CA--C 1.535 0.534 0 C-N-CA 122.349 2.032 . . . . 0.0 113.507 -178.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -90.22 -15.89 30.51 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.256 0.622 . . . . 0.0 112.634 -175.088 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.8 tt -62.74 142.49 58.12 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 118.936 0.789 . . . . 0.0 109.806 170.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 18.2 mm -126.95 136.47 60.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 C-N-CA 124.194 0.998 . . . . 0.0 108.607 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 75.1 m95 -77.94 156.86 79.56 Favored Pre-proline 0 CA--C 1.543 0.693 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 -178.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -67.34 163.33 74.14 Favored 'Cis proline' 0 N--CA 1.458 -0.568 0 C-N-CA 124.633 -0.986 . . . . 0.0 113.355 -9.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -131.79 171.22 13.79 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.218 1.807 . . . . 0.0 110.016 176.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.7 mt -141.52 107.13 5.07 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 125.611 1.564 . . . . 0.0 107.63 -174.256 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.1 tp -84.14 151.27 24.99 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 169.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.453 ' HE3' ' O ' ' A' ' 22' ' ' CYS . 0.1 OUTLIER -142.58 91.5 2.32 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 171.894 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -48.31 136.0 12.92 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 124.522 1.139 . . . . 0.0 110.939 -168.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -66.28 91.5 0.17 Allowed 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 122.122 0.963 . . . . 0.0 111.808 -172.172 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 137.73 -40.43 1.49 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 124.942 1.258 . . . . 0.0 110.308 -178.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.453 ' O ' ' HE3' ' A' ' 18' ' ' LYS . 62.7 m -65.71 173.16 2.97 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 121.544 0.687 . . . . 0.0 110.281 177.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -122.04 -32.36 3.72 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 176.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -60.76 137.89 58.16 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 124.682 1.193 . . . . 0.0 108.417 170.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.4 mt -87.46 154.07 20.93 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 124.427 1.091 . . . . 0.0 108.987 168.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -111.91 86.72 7.71 Favored Pre-proline 0 CA--C 1.542 0.64 0 N-CA-C 105.847 -1.908 . . . . 0.0 105.847 175.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -60.56 140.74 92.81 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 123.936 3.091 . . . . 0.0 109.412 174.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.5 mt -132.89 96.69 3.84 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 106.654 -1.61 . . . . 0.0 106.654 -178.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.8 mtt-85 -53.7 -45.6 70.45 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 124.27 1.028 . . . . 0.0 110.882 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.4 t -157.19 178.14 10.68 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 -172.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -56.84 -34.65 67.97 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 123.716 0.807 . . . . 0.0 111.696 171.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -63.07 -17.74 62.61 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.539 1.063 . . . . 0.0 111.601 177.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -81.55 -44.71 16.93 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.689 1.596 . . . . 0.0 109.03 175.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 57.6 t-105 -57.72 -33.01 67.97 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.051 1.741 . . . . 0.0 112.481 174.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 -65.03 -50.25 66.96 Favored 'General case' 0 C--O 1.232 0.155 0 O-C-N 120.436 -1.415 . . . . 0.0 110.769 172.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 50.6 mtp85 -60.58 -31.74 70.87 Favored 'General case' 0 C--O 1.227 -0.119 0 CA-C-O 117.207 -1.378 . . . . 0.0 112.091 -175.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -49.93 -60.37 2.99 Favored 'General case' 0 N--CA 1.462 0.14 0 C-N-CA 124.42 1.088 . . . . 0.0 110.756 174.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 17.5 p -70.77 -35.07 72.43 Favored 'General case' 0 N--CA 1.453 -0.322 0 O-C-N 122.057 -0.402 . . . . 0.0 110.961 -174.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.05 -27.48 69.13 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 118.941 -0.552 . . . . 0.0 111.094 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -65.4 2.89 0.77 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.518 1.527 . . . . 0.0 113.277 -178.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.9 t 75.73 9.27 3.54 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 127.809 2.443 . . . . 0.0 110.46 -169.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -115.21 44.22 1.87 Allowed 'General case' 0 C--O 1.221 -0.441 0 C-N-CA 125.418 1.487 . . . . 0.0 112.286 -168.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -67.63 20.54 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 116.629 2.085 . . . . 0.0 116.629 -178.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.14 115.66 3.63 Favored 'General case' 0 N--CA 1.439 -0.977 0 C-N-CA 126.607 1.963 . . . . 0.0 110.087 -171.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 81.1 mt -144.37 126.24 15.32 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 -179.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -136.95 157.58 46.42 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 124.621 1.168 . . . . 0.0 109.545 -173.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -65.2 121.33 14.52 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 107.513 -1.291 . . . . 0.0 107.513 179.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 97.1 10.77 54.37 Favored Glycine 0 CA--C 1.535 1.299 0 CA-C-O 117.482 -1.732 . . . . 0.0 114.404 -177.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.3 -13.67 41.25 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-N 120.441 2.121 . . . . 0.0 115.466 178.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt 47.73 144.46 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.531 1 C-N-CA 134.815 5.246 . . . . 0.0 114.632 -176.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 14.8 mt -126.58 156.21 41.23 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 166.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 17.3 t -130.57 141.8 45.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 N-CA-C 104.552 -2.388 . . . . 0.0 104.552 163.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -98.66 179.78 4.56 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.276 1.03 . . . . 0.0 110.539 173.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.6 m -61.98 -3.09 1.07 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 115.881 1.808 . . . . 0.0 115.881 174.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 -120.79 16.2 11.84 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 127.04 2.136 . . . . 0.0 110.368 -176.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 65.33 13.94 9.11 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.819 2.048 . . . . 0.0 112.874 175.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 31.1 m170 -69.04 110.0 4.27 Favored 'General case' 0 C--N 1.329 -0.285 0 O-C-N 120.191 -1.568 . . . . 0.0 109.121 174.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -71.22 143.74 50.34 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 119.501 1.046 . . . . 0.0 108.76 167.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -135.65 159.49 41.47 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 125.397 1.479 . . . . 0.0 109.602 -179.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 30.3 t -141.64 141.33 30.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 C-N-CA 128.158 2.583 . . . . 0.0 105.961 -174.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 22.8 tp -94.42 132.73 38.76 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 128.299 2.64 . . . . 0.0 105.657 174.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 73.3 mt-10 -128.99 174.72 9.28 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.291 1.036 . . . . 0.0 112.11 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -68.38 -18.5 64.48 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 125.622 1.569 . . . . 0.0 114.516 -166.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -77.0 12.34 1.43 Allowed 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.067 1.347 . . . . 0.0 111.256 174.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 45.91 48.48 12.16 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 126.241 1.816 . . . . 0.0 109.693 -170.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -120.44 161.51 21.11 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.544 0.687 . . . . 0.0 110.876 162.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 81.6 m95 -94.75 154.56 17.23 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 106.043 -1.836 . . . . 0.0 106.043 158.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -142.46 161.34 50.45 Favored Pre-proline 0 CA--C 1.54 0.569 0 C-N-CA 123.935 0.894 . . . . 0.0 111.079 -176.02 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.04 134.42 27.35 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 124.313 3.342 . . . . 0.0 111.153 172.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -129.01 21.11 5.83 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.234 1.414 . . . . 0.0 112.833 -176.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 75.59 154.5 0.15 Allowed Pre-proline 0 CA--C 1.539 0.551 0 C-N-CA 131.479 3.912 . . . . 0.0 113.496 -177.22 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -72.0 163.58 38.34 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 121.756 1.638 . . . . 0.0 113.419 -176.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.4 tt -102.37 143.58 26.9 Favored Pre-proline 0 CA--C 1.545 0.762 0 C-N-CA 126.263 1.825 . . . . 0.0 109.273 -173.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -83.01 166.82 14.54 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 123.954 3.103 . . . . 0.0 111.706 -176.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -64.14 -21.27 67.84 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 121.626 1.551 . . . . 0.0 112.96 -175.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -90.34 -20.45 22.85 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.652 1.581 . . . . 0.0 112.928 175.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.02 -32.55 84.53 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-N 119.518 1.054 . . . . 0.0 111.104 -175.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 32.5 tp -59.67 -51.23 70.67 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.065 0.946 . . . . 0.0 108.511 178.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -61.28 -25.05 66.84 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.274 1.829 . . . . 0.0 111.061 178.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -76.43 -47.5 22.87 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.524 1.056 . . . . 0.0 111.029 176.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.42 HD13 ' HA ' ' A' ' 81' ' ' LEU . 1.4 mm? -61.2 -50.35 73.47 Favored 'General case' 0 CA--C 1.521 -0.16 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 177.24 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.7 mm -53.73 -42.24 50.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 C-N-CA 124.022 0.929 . . . . 0.0 109.672 -179.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.9 ttt85 -51.38 -38.57 54.01 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 120.017 1.28 . . . . 0.0 113.614 177.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.15 -49.64 75.06 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 119.774 1.17 . . . . 0.0 109.987 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 24.0 t60 -60.69 -46.0 92.05 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.863 0.865 . . . . 0.0 109.716 176.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 73.2 m -65.04 -34.47 78.51 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 118.297 -0.859 . . . . 0.0 111.886 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -71.45 -40.82 70.11 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 119.019 0.827 . . . . 0.0 111.122 -177.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 8.6 t -71.42 -35.04 70.82 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 118.989 -0.529 . . . . 0.0 110.187 -175.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 64.3 mt -78.42 -47.13 18.2 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 175.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 99.04 53.33 1.18 Allowed Glycine 0 CA--C 1.527 0.838 0 C-N-CA 127.247 2.356 . . . . 0.0 110.625 -178.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 35.3 m-70 -112.27 -178.7 3.48 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 126.118 1.767 . . . . 0.0 111.688 -177.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 5.3 m -117.58 161.13 20.12 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.94 1.296 . . . . 0.0 110.874 -172.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 29.3 p -70.98 22.86 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 126.787 2.035 . . . . 0.0 114.076 -179.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . 0.268 1.7 t 44.03 -87.94 0.01 OUTLIER 'General case' 0 C--O 1.237 0.403 0 C-N-CA 130.18 3.392 . . . . 0.0 111.9 -176.097 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 5.0 p -165.81 -164.23 0.7 Allowed 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 128.598 2.759 . . . . 0.0 105.753 171.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.445 ' HE3' ' HB2' ' A' ' 100' ' ' HIS . 1.6 ttpt 57.36 46.47 18.27 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.389 0.541 . . . . 0.0 112.173 165.319 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 37.4 ttp 59.8 46.08 11.87 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 124.486 1.115 . . . . 0.0 110.968 171.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 8.5 m80 62.75 -66.7 0.09 Allowed 'General case' 0 C--O 1.232 0.16 0 C-N-CA 127.373 2.269 . . . . 0.0 109.539 -159.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.522 HD13 ' HB2' ' A' ' 105' ' ' ALA . 94.1 mt -145.5 154.41 42.18 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 126.205 1.802 . . . . 0.0 108.503 -165.05 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . 0.445 ' HB2' ' HE3' ' A' ' 96' ' ' LYS . 53.8 t-80 -96.41 -28.78 14.29 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.127 -0.488 . . . . 0.0 112.271 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.6 t -171.63 179.85 2.72 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.432 1.493 . . . . 0.0 108.508 -177.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 60.6 t -65.21 -37.09 79.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 O-C-N 121.325 -0.859 . . . . 0.0 110.989 -177.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 3.7 tpt -59.05 -38.56 79.65 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 121.916 -0.49 . . . . 0.0 109.919 177.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -63.73 -44.31 93.94 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 124.27 1.028 . . . . 0.0 109.166 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.522 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -55.67 -52.0 65.32 Favored 'General case' 0 C--N 1.34 0.195 0 C-N-CA 125.599 1.56 . . . . 0.0 112.404 -178.221 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 30.0 mm -61.98 -44.08 98.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 -175.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.68 -40.78 92.71 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.151 0.58 . . . . 0.0 110.418 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -55.28 -55.17 34.5 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 124.318 1.047 . . . . 0.0 109.686 176.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 6.8 mt -61.64 -45.57 93.48 Favored 'General case' 0 CA--C 1.517 -0.315 0 O-C-N 124.182 0.926 . . . . 0.0 110.679 -176.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 -59.35 -43.41 92.81 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 118.988 -0.53 . . . . 0.0 110.065 179.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.8 -12.76 61.86 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 -177.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 57.2 mt -67.03 -63.57 1.03 Allowed 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 120.155 1.343 . . . . 0.0 109.162 177.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 54.34 32.95 17.39 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 128.688 2.795 . . . . 0.0 113.802 -179.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.206 0 C-N-CA 126.986 2.231 . . . . 0.0 108.607 172.19 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.6 ptp . . . . . 0 N--CA 1.474 0.77 0 CA-C-O 117.673 -1.156 . . . . 0.0 112.276 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -55.93 -62.28 6.49 Favored Glycine 0 C--N 1.341 0.823 0 CA-C-N 118.872 0.76 . . . . 0.0 111.791 -176.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 53.83 -154.32 0.25 Allowed 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 117.408 0.604 . . . . 0.0 110.883 -175.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -160.18 -168.42 22.1 Favored Glycine 0 CA--C 1.523 0.55 0 O-C-N 120.867 -1.146 . . . . 0.0 110.907 -177.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -134.58 86.23 2.25 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 -171.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -149.06 155.21 40.19 Favored Pre-proline 0 C--N 1.321 -0.658 0 C-N-CA 124.638 1.175 . . . . 0.0 110.816 -173.435 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -68.4 -54.66 0.28 Allowed 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.598 2.199 . . . . 0.0 111.931 176.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 20.3 t-80 -161.94 144.21 8.71 Favored Pre-proline 0 CA--C 1.536 0.427 0 CA-C-N 119.853 1.206 . . . . 0.0 108.661 174.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -73.64 -1.73 11.16 Favored 'Trans proline' 0 CA--C 1.536 0.609 0 C-N-CA 122.93 2.42 . . . . 0.0 114.216 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -113.11 -3.93 13.89 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.743 1.217 . . . . 0.0 112.23 177.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.7 tt -66.77 117.02 8.31 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 163.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 29.4 mm -100.05 103.9 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 177.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 71.9 m95 -53.47 150.51 12.28 Favored Pre-proline 0 CA--C 1.533 0.292 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.761 176.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -68.88 167.91 66.2 Favored 'Cis proline' 0 N--CA 1.456 -0.696 0 N-CA-C 114.878 1.069 . . . . 0.0 114.878 -0.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -139.23 167.78 21.3 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 124.831 1.252 . . . . 0.0 110.741 -179.483 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.5 mt -140.53 114.32 8.9 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 125.734 1.613 . . . . 0.0 108.488 -172.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.481 HD11 ' HB3' ' A' ' 49' ' ' ASP . 18.7 tp -95.7 143.77 26.67 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.602 1.561 . . . . 0.0 109.015 178.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -146.21 98.05 3.03 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 119.616 1.098 . . . . 0.0 110.769 175.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -58.87 160.31 5.99 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-O 122.687 1.232 . . . . 0.0 112.658 -173.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -76.12 99.87 4.8 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 122.63 1.205 . . . . 0.0 111.981 174.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 126.89 -39.43 1.97 Allowed Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 126.229 1.871 . . . . 0.0 108.506 169.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 41.6 m -65.67 165.07 13.18 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 124.568 1.147 . . . . 0.0 109.647 174.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 -122.16 -28.16 4.42 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 124.914 1.286 . . . . 0.0 109.539 -178.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -60.82 115.11 3.43 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 127.825 2.45 . . . . 0.0 109.177 -178.048 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -72.4 147.61 46.04 Favored 'General case' 0 N--CA 1.463 0.197 0 O-C-N 121.103 -0.998 . . . . 0.0 109.496 172.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.06 87.61 9.08 Favored Pre-proline 0 CA--C 1.535 0.369 0 C-N-CA 125.48 1.512 . . . . 0.0 108.945 176.084 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -63.48 127.54 20.15 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 122.641 2.227 . . . . 0.0 110.73 172.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -114.72 107.75 15.87 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 125.996 1.718 . . . . 0.0 107.604 169.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.7 mtt-85 -61.85 -45.79 92.29 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.045 0.384 . . . . 0.0 111.186 -178.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 13.3 t -146.85 -176.1 5.07 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 121.918 0.866 . . . . 0.0 110.54 174.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -54.44 -38.35 66.21 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 124.789 1.236 . . . . 0.0 110.085 -179.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.73 -19.85 63.54 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 121.423 0.63 . . . . 0.0 111.498 -177.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -78.47 -35.12 47.05 Favored 'General case' 0 CA--C 1.521 -0.164 0 O-C-N 120.151 -1.593 . . . . 0.0 109.923 175.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 49.9 t-105 -64.03 -34.93 79.12 Favored 'General case' 0 C--O 1.234 0.266 0 O-C-N 121.455 -0.778 . . . . 0.0 110.615 170.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -57.5 -57.15 13.96 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-O 118.834 -0.603 . . . . 0.0 109.771 168.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.544 ' HA ' ' HB3' ' A' ' 39' ' ' ALA . 0.0 OUTLIER -72.83 -20.22 61.18 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 117.543 -1.663 . . . . 0.0 109.632 -168.499 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -52.15 -64.31 0.86 Allowed 'General case' 0 CA--C 1.519 -0.233 0 O-C-N 120.149 -1.594 . . . . 0.0 109.343 -177.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 1.9 m -80.48 -16.2 54.9 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-O 116.614 -1.66 . . . . 0.0 111.139 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.544 ' HB3' ' HA ' ' A' ' 36' ' ' ARG . . . -51.93 -45.46 64.3 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 120.344 1.429 . . . . 0.0 110.821 160.494 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -115.26 -4.74 12.38 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -156.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 8.1 t -144.81 -21.55 0.51 Allowed 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.628 1.171 . . . . 0.0 112.522 -174.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.2 pttt 44.47 26.1 0.16 Allowed 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 128.47 2.708 . . . . 0.0 115.351 176.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -60.33 150.84 29.36 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.88 0.848 . . . . 0.0 110.818 -159.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.1 tt -56.18 129.01 38.37 Favored 'General case' 0 N--CA 1.439 -0.99 0 C-N-CA 125.971 1.708 . . . . 0.0 110.022 175.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 57.9 mt -111.57 124.3 52.0 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.914 1.286 . . . . 0.0 107.646 -179.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -129.7 147.21 51.46 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.656 1.582 . . . . 0.0 107.943 -177.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.591 ' HA ' HD13 ' A' ' 61' ' ' LEU . 40.3 m-85 -67.16 91.32 0.22 Allowed 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 124.858 1.263 . . . . 0.0 110.629 -167.435 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 140.48 15.93 0.48 Allowed Glycine 0 CA--C 1.528 0.889 0 C-N-CA 124.203 0.906 . . . . 0.0 113.336 -179.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.481 ' HB3' HD11 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -56.13 -9.97 0.74 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 127.768 2.427 . . . . 0.0 115.321 171.779 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.2 ttmt 44.42 115.69 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 130.808 3.643 . . . . 0.0 113.737 175.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 16.1 mt -104.42 155.19 19.0 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 167.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 23.7 t -136.81 142.94 36.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 N-CA-C 105.952 -1.87 . . . . 0.0 105.952 160.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.68 -170.56 1.78 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.829 1.652 . . . . 0.0 111.018 179.126 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.6 m -72.55 -15.69 61.76 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 176.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 -80.14 -3.95 50.93 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.829 1.251 . . . . 0.0 112.469 168.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 63.88 19.49 11.76 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.521 1.128 . . . . 0.0 109.88 -170.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 66.6 m170 -67.06 107.44 2.28 Favored 'General case' 0 CA--C 1.518 -0.266 0 O-C-N 120.215 -1.553 . . . . 0.0 106.918 170.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -74.04 153.86 39.49 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 121.952 0.882 . . . . 0.0 109.577 168.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -135.4 167.95 20.11 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 125.784 1.633 . . . . 0.0 108.511 -178.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 53.4 t -145.21 142.01 22.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 104.772 -2.307 . . . . 0.0 104.772 172.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.591 HD13 ' HA ' ' A' ' 47' ' ' TYR . 0.1 OUTLIER -81.6 124.53 29.62 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 106.379 -1.712 . . . . 0.0 106.379 170.461 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -109.21 161.25 15.41 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 118.516 0.598 . . . . 0.0 109.533 -178.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -55.84 -14.84 2.63 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -175.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.93 -11.04 57.98 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.937 1.295 . . . . 0.0 112.78 170.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 74.45 8.16 4.49 Favored 'General case' 0 C--N 1.351 0.643 0 C-N-CA 126.236 1.815 . . . . 0.0 111.193 -165.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -94.26 164.35 13.07 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 118.783 0.72 . . . . 0.0 111.403 177.081 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -107.96 107.28 17.91 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 107.645 -1.242 . . . . 0.0 107.645 173.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 -79.98 143.58 57.72 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -71.78 105.27 1.76 Allowed 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 124.606 3.537 . . . . 0.0 109.815 170.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.92 28.69 0.09 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.061 1.344 . . . . 0.0 111.559 170.026 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.494 ' HB1' ' HD2' ' A' ' 72' ' ' PRO . . . 67.8 166.71 0.12 Allowed Pre-proline 0 CA--C 1.539 0.53 0 C-N-CA 125.79 1.636 . . . . 0.0 111.602 -178.466 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.494 ' HD2' ' HB1' ' A' ' 71' ' ' ALA . 72.0 Cg_endo -64.36 162.88 28.62 Favored 'Trans proline' 0 N--CA 1.45 -1.052 0 C-N-CA 120.47 0.78 . . . . 0.0 110.925 168.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 20.7 tp -122.67 144.63 43.01 Favored Pre-proline 0 N--CA 1.448 -0.575 0 C-N-CA 126.717 2.007 . . . . 0.0 106.262 -178.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -62.24 160.68 29.8 Favored 'Trans proline' 0 N--CA 1.453 -0.91 0 C-N-CA 121.608 1.538 . . . . 0.0 110.445 174.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -59.97 -25.12 78.72 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 122.28 1.987 . . . . 0.0 112.487 179.168 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -89.2 -20.04 24.68 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 126.549 1.94 . . . . 0.0 109.764 -174.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.06 -23.17 78.37 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 123.814 0.721 . . . . 0.0 112.432 176.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 27.9 tp -55.66 -46.99 77.42 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.311 1.044 . . . . 0.0 109.847 169.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -58.45 -26.17 63.03 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.452 1.501 . . . . 0.0 111.379 -175.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -74.79 -24.35 58.64 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.18 1.392 . . . . 0.0 113.158 177.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 93.7 mt -84.94 -53.56 5.23 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 175.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.7 mm -56.74 -28.06 27.11 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 125.395 1.478 . . . . 0.0 110.258 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -44.14 -46.45 8.75 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 125.581 1.552 . . . . 0.0 111.172 174.418 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.73 -48.77 77.77 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 123.525 0.73 . . . . 0.0 111.718 -176.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.441 ' NE2' HD12 ' A' ' 112' ' ' LEU . 13.0 t60 -59.32 -46.62 88.11 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.368 0.667 . . . . 0.0 109.716 177.694 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 78.2 m -68.92 -31.99 71.28 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 120.896 -1.127 . . . . 0.0 111.129 -178.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -80.63 -12.51 59.49 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 125.111 1.365 . . . . 0.0 113.557 -179.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.0 t -95.57 -4.41 44.7 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.107 0.867 . . . . 0.0 110.981 170.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 88.9 mt -122.72 -46.84 2.1 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 119.89 1.223 . . . . 0.0 111.66 -174.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 119.95 57.59 0.25 Allowed Glycine 0 CA--C 1.528 0.891 0 C-N-CA 125.239 1.399 . . . . 0.0 112.529 178.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -130.84 159.77 36.38 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 118.975 1.388 . . . . 0.0 112.674 -179.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 96.4 m -138.22 -56.51 0.65 Allowed 'General case' 0 C--N 1.348 0.503 0 C-N-CA 124.38 1.072 . . . . 0.0 112.918 175.041 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 4.6 p 176.68 154.7 0.23 Allowed 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 126.438 1.895 . . . . 0.0 111.649 178.139 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 9.8 t -149.11 144.92 26.95 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.166 1.386 . . . . 0.0 108.348 -179.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 75.7 m 54.63 -63.48 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 128.268 2.627 . . . . 0.0 115.905 -174.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.61 ' HE3' ' HB2' ' A' ' 100' ' ' HIS . 0.0 OUTLIER -109.04 -158.03 0.63 Allowed 'General case' 0 C--O 1.238 0.477 0 C-N-CA 125.08 1.352 . . . . 0.0 109.257 -176.543 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.42 ' HG2' ' H ' ' A' ' 98' ' ' HIS . 8.5 ttp -64.96 179.43 0.68 Allowed 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 172.188 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . 0.42 ' H ' ' HG2' ' A' ' 97' ' ' MET . 17.2 t-160 -44.58 -60.88 1.77 Allowed 'General case' 0 CA--C 1.519 -0.245 0 C-N-CA 126.584 1.953 . . . . 0.0 111.86 179.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.614 HD13 ' HB2' ' A' ' 105' ' ' ALA . 84.2 mt -138.85 146.76 41.6 Favored 'General case' 0 CA--C 1.514 -0.43 0 C-N-CA 124.647 1.179 . . . . 0.0 107.907 169.306 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . 0.61 ' HB2' ' HE3' ' A' ' 96' ' ' LYS . 12.1 t-80 -79.45 -36.31 39.06 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 124.557 1.143 . . . . 0.0 112.539 -179.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 24.2 p -170.64 174.0 5.19 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 126.18 1.792 . . . . 0.0 108.625 -177.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 68.7 t -62.62 -45.74 98.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-O 118.714 -0.66 . . . . 0.0 109.929 177.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 46.8 tpp -62.77 -46.05 89.82 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.843 1.201 . . . . 0.0 110.155 -177.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.29 -35.44 69.8 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 178.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.614 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -62.42 -41.77 98.94 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 123.652 0.781 . . . . 0.0 112.492 174.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 29.1 mm -56.02 -49.99 72.33 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-N 119.364 0.984 . . . . 0.0 108.889 -177.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.67 -40.73 63.47 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.123 -176.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.445 ' CE2' HD11 ' A' ' 112' ' ' LEU . 90.4 t80 -50.29 -59.16 4.24 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.535 0.734 . . . . 0.0 111.454 173.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 74.4 mt -58.29 -35.57 72.0 Favored 'General case' 0 CA--C 1.522 -0.125 0 C-N-CA 125.289 1.436 . . . . 0.0 112.159 -174.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -69.16 -46.12 68.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 119.227 -0.416 . . . . 0.0 110.355 174.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -69.61 -11.65 61.01 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.132 0.973 . . . . 0.0 112.829 -178.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.445 HD11 ' CE2' ' A' ' 108' ' ' PHE . 19.8 mt -71.71 -37.39 70.66 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 119.279 0.945 . . . . 0.0 110.687 169.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.8 172.81 12.88 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-O 122.043 0.925 . . . . 0.0 109.762 172.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.846 0 N-CA-C 107.809 -2.116 . . . . 0.0 107.809 171.903 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 40.2 tpp . . . . . 0 N--CA 1.469 0.508 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -121.76 -169.57 13.63 Favored Glycine 0 CA--C 1.523 0.537 0 C-N-CA 123.36 0.505 . . . . 0.0 113.248 -154.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -76.97 166.85 22.77 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 125.593 1.557 . . . . 0.0 110.704 176.059 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.67 -8.73 87.18 Favored Glycine 0 CA--C 1.531 1.04 0 O-C-N 121.816 -0.552 . . . . 0.0 113.641 -178.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 12.8 mp0 -90.6 10.24 26.41 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 118.289 1.044 . . . . 0.0 113.012 -170.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 14.2 p -126.85 159.87 62.0 Favored Pre-proline 0 C--O 1.239 0.519 0 CA-C-N 118.466 0.575 . . . . 0.0 109.499 -176.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -97.47 84.06 0.07 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.173 0 C-N-CA 122.61 2.207 . . . . 0.0 110.588 -177.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 75.4 143.66 0.1 OUTLIER Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 128.91 2.884 . . . . 0.0 110.455 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -84.11 -15.89 6.47 Favored 'Trans proline' 0 CA--C 1.535 0.548 0 C-N-CA 122.921 2.414 . . . . 0.0 112.21 175.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.9 -13.52 59.98 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.736 0.814 . . . . 0.0 110.559 175.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 tt -68.43 130.97 44.46 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-N 118.385 0.539 . . . . 0.0 110.542 169.448 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 8.0 mm -119.08 102.55 13.16 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 126.602 1.961 . . . . 0.0 108.258 -179.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 84.5 m95 -58.84 148.83 67.42 Favored Pre-proline 0 CA--C 1.54 0.566 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 -175.327 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.99 172.45 56.93 Favored 'Cis proline' 0 N--CA 1.455 -0.776 0 N-CA-C 114.271 0.835 . . . . 0.0 114.271 5.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.449 ' HB1' HD22 ' A' ' 51' ' ' LEU . . . -144.17 166.11 25.96 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.306 172.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.9 mt -132.91 105.97 7.42 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 125.29 1.436 . . . . 0.0 107.333 -178.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 29.9 tp -66.9 142.03 57.44 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 171.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.14 94.53 2.54 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 107.47 -1.307 . . . . 0.0 107.47 165.365 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -59.32 155.9 13.7 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 126.013 1.725 . . . . 0.0 110.145 -173.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -63.79 116.47 5.78 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 127.453 2.301 . . . . 0.0 109.726 -173.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 79.9 -11.22 35.79 Favored Glycine 0 CA--C 1.528 0.898 0 CA-C-O 118.523 -1.154 . . . . 0.0 113.516 178.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 50.7 m -72.05 178.14 3.96 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.644 1.722 . . . . 0.0 109.688 167.419 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -142.47 -22.13 0.67 Allowed 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 125.166 1.386 . . . . 0.0 111.704 -178.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.49 148.14 49.92 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 166.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -104.96 150.09 25.2 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 170.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.448 HD22 ' HA ' ' A' ' 26' ' ' LEU . 0.2 OUTLIER -106.75 88.54 3.58 Favored Pre-proline 0 C--O 1.234 0.254 0 C-N-CA 126.923 2.089 . . . . 0.0 110.883 175.372 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -56.82 131.32 44.85 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.579 2.186 . . . . 0.0 110.337 177.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -123.55 97.63 5.47 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 125.91 1.684 . . . . 0.0 107.477 172.09 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.5 mtt85 -56.18 -45.54 79.71 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 118.584 0.629 . . . . 0.0 110.939 177.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 12.3 t -148.82 -175.6 5.01 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 121.737 0.779 . . . . 0.0 110.054 173.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -54.12 -34.58 60.66 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.176 1.39 . . . . 0.0 111.61 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -61.22 -41.23 96.48 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.216 0.532 . . . . 0.0 109.878 178.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.422 ' HA ' ' HD2' ' A' ' 36' ' ' ARG . 16.9 m-20 -70.49 -27.87 64.54 Favored 'General case' 0 C--O 1.232 0.141 0 C-N-CA 125.471 1.508 . . . . 0.0 110.639 -177.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 42.5 t-105 -68.08 -50.97 51.67 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.989 0.916 . . . . 0.0 110.242 166.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -58.76 -38.9 79.48 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 118.723 0.692 . . . . 0.0 110.115 -177.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.422 ' HD2' ' HA ' ' A' ' 33' ' ' ASP . 63.6 mtt180 -59.55 -13.42 9.14 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 177.052 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -77.68 -66.98 0.77 Allowed 'General case' 0 CA--C 1.528 0.116 0 CA-C-N 120.844 1.657 . . . . 0.0 108.841 167.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 16.8 p -69.0 -13.69 62.61 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 114.467 1.284 . . . . 0.0 114.467 -172.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -82.58 -21.92 35.05 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 125.581 1.552 . . . . 0.0 112.63 172.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -149.22 2.1 0.56 Allowed 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 115.357 1.614 . . . . 0.0 115.357 -156.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 44.6 t -149.77 -65.68 0.21 Allowed 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 -174.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 33.8 pttt 56.1 23.26 6.71 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 117.569 2.433 . . . . 0.0 117.569 159.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -117.02 11.9 14.41 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 115.15 1.537 . . . . 0.0 115.15 -166.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.403 ' O ' HD23 ' A' ' 45' ' ' LEU . 12.8 mt -152.61 79.12 1.21 Allowed 'General case' 0 N--CA 1.432 -1.332 0 CA-C-N 115.058 -0.973 . . . . 0.0 108.934 -159.021 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.403 HD23 ' O ' ' A' ' 44' ' ' LEU . 92.8 mt -149.31 101.83 3.16 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 -175.596 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -122.07 156.39 33.67 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.752 1.221 . . . . 0.0 109.265 -167.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.477 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 14.8 m-85 -68.59 96.18 0.69 Allowed 'General case' 0 C--O 1.233 0.236 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 174.298 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 131.31 7.61 3.13 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 124.153 0.883 . . . . 0.0 113.516 -176.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.43 -20.56 55.98 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 116.142 1.905 . . . . 0.0 116.142 -168.39 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.565 ' H ' HG23 ' A' ' 60' ' ' VAL . 11.0 ttmt 44.59 128.54 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 130.784 3.634 . . . . 0.0 118.572 171.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.449 HD22 ' HB1' ' A' ' 15' ' ' ALA . 5.3 mt -127.86 151.98 48.39 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 124.605 1.162 . . . . 0.0 109.079 178.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 81.6 t -127.03 142.11 44.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 N-CA-C 104.959 -2.237 . . . . 0.0 104.959 163.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 14.3 p-10 -107.56 176.51 5.13 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 124.736 1.214 . . . . 0.0 110.872 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.23 -11.31 30.01 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.103 0.961 . . . . 0.0 112.846 -179.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -99.83 6.05 45.4 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.475 1.51 . . . . 0.0 110.37 179.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 66.25 18.32 10.9 Favored 'General case' 0 C--N 1.344 0.36 0 C-N-CA 127.158 2.183 . . . . 0.0 112.075 -178.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 22.5 m170 -75.31 117.28 16.95 Favored 'General case' 0 N--CA 1.443 -0.803 0 O-C-N 120.99 -1.069 . . . . 0.0 108.892 175.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 57.1 m -75.49 138.02 41.3 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 169.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -143.5 158.0 44.0 Favored 'General case' 0 C--N 1.334 -0.105 0 C-N-CA 126.244 1.817 . . . . 0.0 111.071 177.442 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.565 HG23 ' H ' ' A' ' 50' ' ' LYS . 4.1 p -152.45 151.21 12.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 168.097 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 34.3 tp -69.38 132.7 46.8 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 127.176 2.19 . . . . 0.0 109.41 173.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -113.51 174.98 5.65 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.973 1.309 . . . . 0.0 109.399 178.053 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.477 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 28.4 mt-10 -64.31 -20.49 66.12 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 125.715 1.606 . . . . 0.0 113.146 -177.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -82.0 6.08 17.23 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.416 1.487 . . . . 0.0 111.612 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 68.03 -4.52 1.01 Allowed 'General case' 0 C--O 1.237 0.404 0 C-N-CA 128.874 2.87 . . . . 0.0 113.931 -175.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -77.49 168.3 20.23 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 119.378 0.99 . . . . 0.0 111.959 172.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.447 ' CZ3' ' HA ' ' A' ' 60' ' ' VAL . 22.2 m95 -107.99 144.02 35.86 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 107.407 -1.331 . . . . 0.0 107.407 166.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -134.22 151.73 76.96 Favored Pre-proline 0 C--N 1.331 -0.235 0 C-N-CA 124.557 1.143 . . . . 0.0 111.626 -167.729 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -74.71 146.95 34.62 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 124.026 3.151 . . . . 0.0 112.607 -172.398 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -135.07 36.49 3.03 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.205 1.402 . . . . 0.0 111.927 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 70.99 166.4 0.13 Allowed Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 126.519 1.928 . . . . 0.0 111.896 -177.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.02 176.38 9.99 Favored 'Trans proline' 0 CA--C 1.535 0.543 0 C-N-CA 121.386 1.39 . . . . 0.0 111.269 170.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 14.5 tp -120.77 151.35 54.41 Favored Pre-proline 0 CA--C 1.543 0.675 0 C-N-CA 125.17 1.388 . . . . 0.0 110.234 -176.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -73.27 163.16 38.66 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.837 2.358 . . . . 0.0 111.171 168.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.0 -25.17 23.17 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 122.423 2.082 . . . . 0.0 112.879 179.104 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -83.36 -19.03 36.86 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 119.132 0.878 . . . . 0.0 110.636 176.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.69 -18.2 51.7 Favored Glycine 0 CA--C 1.532 1.111 0 N-CA-C 111.269 -0.733 . . . . 0.0 111.269 171.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 40.3 tp -60.0 -54.06 50.47 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 124.836 1.254 . . . . 0.0 108.429 170.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -62.73 -24.64 67.78 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 125.501 1.521 . . . . 0.0 112.239 179.556 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 -66.91 -45.4 78.06 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 120.393 1.451 . . . . 0.0 109.874 172.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -67.62 -54.98 15.18 Favored 'General case' 0 C--O 1.231 0.111 0 N-CA-C 108.218 -1.031 . . . . 0.0 108.218 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 12.2 mm -55.7 -32.22 30.95 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 125.165 1.386 . . . . 0.0 110.961 -178.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.81 -57.04 4.63 Favored 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 124.259 1.023 . . . . 0.0 111.447 175.325 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -70.5 -34.87 72.82 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 120.341 -0.543 . . . . 0.0 111.58 -170.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 28.5 t60 -60.67 -53.16 60.85 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.661 0.784 . . . . 0.0 109.852 175.442 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 99.6 m -63.8 -37.91 89.15 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 118.296 -0.859 . . . . 0.0 110.484 179.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.06 -36.49 77.73 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 119.242 0.928 . . . . 0.0 112.402 -179.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 13.1 t -70.06 -32.82 71.11 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.886 0.766 . . . . 0.0 110.479 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 63.8 mt -80.03 -56.59 4.14 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.721 0.808 . . . . 0.0 109.682 177.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 135.19 7.83 1.91 Allowed Glycine 0 CA--C 1.539 1.548 0 C-N-CA 126.004 1.764 . . . . 0.0 114.055 -175.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 39.3 m-70 -87.01 170.49 11.52 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 119.956 1.878 . . . . 0.0 110.488 -179.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 5.6 m -140.81 -27.75 0.71 Allowed 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 116.153 1.908 . . . . 0.0 116.153 175.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -178.58 175.21 1.13 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.304 1.441 . . . . 0.0 111.162 -173.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.466 HG23 ' H ' ' A' ' 95' ' ' SER 0.27 12.3 t -142.68 -74.56 0.28 Allowed 'General case' 0 N--CA 1.445 -0.697 0 C-N-CA 125.904 1.682 . . . . 0.0 107.385 179.041 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . 0.466 ' H ' HG23 ' A' ' 94' ' ' THR . 2.5 p -158.04 -178.48 7.33 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.827 1.251 . . . . 0.0 110.207 -178.111 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.434 ' HE2' ' HB2' ' A' ' 100' ' ' HIS . 43.9 tttt 66.12 17.45 10.76 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 114.377 1.251 . . . . 0.0 114.377 156.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 9.7 tmm? 53.4 87.18 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.428 1.891 . . . . 0.0 107.988 -157.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 58.8 m80 48.32 -86.16 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 127.383 2.273 . . . . 0.0 112.84 -174.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 43.1 mt -148.07 128.89 14.31 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 127.567 2.347 . . . . 0.0 106.309 -160.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . 0.434 ' HB2' ' HE2' ' A' ' 96' ' ' LYS . 2.1 t-80 -66.57 -46.24 76.68 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.924 0.393 . . . . 0.0 110.331 -176.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 74.3 m -153.72 174.04 15.05 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.264 1.426 . . . . 0.0 110.292 -171.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 38.8 t -50.41 -39.74 17.52 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 C-N-CA 126.799 2.04 . . . . 0.0 109.496 173.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 20.9 tpp -57.1 -40.03 76.22 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 124.186 0.994 . . . . 0.0 113.386 177.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -69.89 -42.1 73.86 Favored 'General case' 0 N--CA 1.463 0.177 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 177.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.74 -45.6 91.97 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.785 1.234 . . . . 0.0 112.381 -172.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 11.0 mm -58.05 -43.9 86.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -66.85 -46.43 75.1 Favored 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 124.154 0.981 . . . . 0.0 110.411 -178.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 36.1 t80 -53.71 -61.48 2.27 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 125.516 1.526 . . . . 0.0 110.063 177.391 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 7.2 mp -50.34 -46.76 55.92 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.154 1.382 . . . . 0.0 112.384 175.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -63.0 -36.77 84.66 Favored 'General case' 0 C--N 1.333 -0.142 0 O-C-N 123.323 0.39 . . . . 0.0 111.591 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -74.86 -26.13 59.46 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 118.542 -0.742 . . . . 0.0 111.584 179.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 29.2 mt -63.96 -60.78 2.83 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 124.043 0.937 . . . . 0.0 109.358 -177.331 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 49.37 21.29 0.54 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 127.904 2.481 . . . . 0.0 116.709 176.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.661 -1.077 . . . . 0.0 111.625 168.96 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.517 -0.304 0 N-CA-C 106.046 -1.835 . . . . 0.0 106.046 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 134.0 82.1 0.18 Allowed Glycine 0 CA--C 1.521 0.448 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -164.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 45.52 -154.94 0.04 OUTLIER 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.622 1.969 . . . . 0.0 115.11 170.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -175.61 -101.94 0.15 Allowed Glycine 0 C--N 1.333 0.39 0 N-CA-C 106.788 -2.525 . . . . 0.0 106.788 175.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -84.63 15.76 3.62 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.64 1.176 . . . . 0.0 111.711 -178.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -113.9 157.28 42.34 Favored Pre-proline 0 N--CA 1.446 -0.627 0 C-N-CA 127.708 2.403 . . . . 0.0 109.924 -176.488 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.24 -55.04 0.07 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.207 0 C-N-CA 121.756 1.637 . . . . 0.0 110.883 177.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 19.0 t-80 -150.56 147.41 21.36 Favored Pre-proline 0 CA--C 1.534 0.338 0 C-N-CA 125.732 1.613 . . . . 0.0 107.708 -178.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -69.11 -38.62 8.94 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 122.795 2.33 . . . . 0.0 111.885 176.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.29 -17.58 61.86 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 117.901 -1.047 . . . . 0.0 112.255 -176.167 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.9 tt -58.74 122.6 13.93 Favored 'General case' 0 C--N 1.346 0.425 0 CA-C-N 118.692 0.678 . . . . 0.0 109.315 170.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.434 ' CG1' HD21 ' A' ' 55' ' ' ASN . 43.6 mm -109.95 117.43 54.66 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.257 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 176.28 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -55.17 152.51 14.88 Favored Pre-proline 0 CA--C 1.534 0.335 0 C-N-CA 123.841 0.856 . . . . 0.0 111.114 174.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -73.38 174.27 51.24 Favored 'Cis proline' 0 CA--C 1.535 0.541 0 C-N-CA 125.204 -0.749 . . . . 0.0 112.792 -0.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -138.55 173.06 11.99 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 121.234 0.54 . . . . 0.0 111.887 177.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.423 HD22 HD12 ' A' ' 25' ' ' LEU . 18.8 mt -139.78 110.38 6.71 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 126.014 1.725 . . . . 0.0 109.301 -175.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.8 tp -87.2 150.81 23.68 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.365 1.066 . . . . 0.0 108.303 167.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.13 84.84 2.06 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 119.895 1.225 . . . . 0.0 108.621 170.241 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.465 ' NE2' HE21 ' A' ' 46' ' ' GLN . 0.1 OUTLIER -52.41 134.15 34.63 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 122.815 0.446 . . . . 0.0 111.273 -168.84 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -64.27 125.94 26.18 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.13 -0.941 . . . . 0.0 108.909 -168.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 98.29 -19.99 52.29 Favored Glycine 0 CA--C 1.527 0.815 0 CA-C-O 118.241 -1.311 . . . . 0.0 112.168 -178.405 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 2.3 t -88.85 -177.09 5.42 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 119.423 1.612 . . . . 0.0 109.989 174.263 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.1 m-80 -127.66 -12.66 5.44 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 124.644 1.178 . . . . 0.0 110.105 170.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -76.13 126.73 31.53 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 -176.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.511 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 3.5 mm? -75.51 147.32 39.85 Favored 'General case' 0 CA--C 1.52 -0.207 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 168.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -108.6 87.26 4.17 Favored Pre-proline 0 CA--C 1.537 0.453 0 C-N-CA 126.309 1.844 . . . . 0.0 109.081 175.057 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -66.32 113.09 2.53 Favored 'Trans proline' 0 N--CA 1.46 -0.496 0 C-N-CA 123.499 2.799 . . . . 0.0 109.901 177.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.2 mt -112.18 107.84 16.87 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 -177.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -51.65 -47.77 63.62 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 126.478 1.911 . . . . 0.0 111.587 -176.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.3 t -163.91 -179.25 6.16 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-O 121.949 0.88 . . . . 0.0 108.721 -168.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -68.33 -21.94 64.72 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 115.106 -0.952 . . . . 0.0 112.387 -175.384 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -69.85 -35.39 74.69 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 123.631 0.772 . . . . 0.0 110.626 169.224 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.8 t0 -67.03 -41.32 86.81 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 123.661 0.784 . . . . 0.0 109.423 177.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 75.5 t-105 -54.01 -41.06 67.57 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 121.536 -0.727 . . . . 0.0 111.193 172.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -71.91 -37.13 70.13 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 118.466 -0.778 . . . . 0.0 111.574 176.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.03 -50.29 74.65 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 119.485 1.039 . . . . 0.0 109.972 172.483 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -51.7 -57.03 10.37 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 119.289 0.95 . . . . 0.0 111.265 -173.21 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 25.7 p -67.24 -22.31 65.7 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.605 -0.725 . . . . 0.0 112.015 -175.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -77.81 -48.61 16.12 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.292 1.037 . . . . 0.0 112.832 171.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -102.01 -16.67 16.39 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.217 1.192 . . . . 0.0 114.217 -153.363 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 64.0 p -139.64 -32.3 0.64 Allowed 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 125.882 1.673 . . . . 0.0 111.291 -178.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.9 ttmt 70.29 -50.59 0.65 Allowed 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 129.799 3.24 . . . . 0.0 114.071 174.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER 45.13 21.68 0.06 Allowed 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 127.706 2.402 . . . . 0.0 115.309 172.265 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.556 ' N ' HD12 ' A' ' 44' ' ' LEU . 2.5 mp 50.45 -177.09 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 127.182 2.193 . . . . 0.0 112.822 -172.772 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.1 mt -141.3 131.85 25.45 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 165.256 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.465 HE21 ' NE2' ' A' ' 19' ' ' GLN . 21.8 pt20 -140.33 163.06 33.79 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.315 1.046 . . . . 0.0 110.987 -174.759 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -76.19 70.92 2.88 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.622 1.169 . . . . 0.0 110.959 -171.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 152.03 18.18 0.06 OUTLIER Glycine 0 CA--C 1.524 0.6 0 CA-C-O 118.908 -0.94 . . . . 0.0 114.433 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -71.22 -17.04 62.53 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.305 1.442 . . . . 0.0 113.437 179.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 52.25 154.91 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 129.869 3.267 . . . . 0.0 113.454 -174.302 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.7 tp -136.73 151.62 49.43 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 106.156 -1.794 . . . . 0.0 106.156 169.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 39.8 t -134.46 141.03 44.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 105.359 -2.089 . . . . 0.0 105.359 163.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -106.15 -178.67 3.72 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.077 1.351 . . . . 0.0 111.422 176.354 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.3 t -58.75 -24.39 61.55 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.271 1.428 . . . . 0.0 112.62 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.434 HD21 ' CG1' ' A' ' 12' ' ' ILE . 47.5 m-80 -90.23 1.04 56.9 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 124.498 1.119 . . . . 0.0 111.618 -179.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 65.93 24.05 11.22 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.519 1.128 . . . . 0.0 111.254 -173.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 24.3 m170 -69.11 108.52 3.61 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 164.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 92.8 m -70.81 153.35 42.83 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 121.702 0.763 . . . . 0.0 109.055 164.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -142.86 156.33 44.91 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.334 1.454 . . . . 0.0 108.157 170.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 25.7 t -135.19 144.69 33.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 C-N-CA 125.667 1.587 . . . . 0.0 107.78 166.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 11.9 tp -75.29 129.76 37.95 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 128.859 2.864 . . . . 0.0 106.872 175.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -120.91 170.55 9.38 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -178.197 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -61.09 -23.52 65.55 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 123.762 0.825 . . . . 0.0 112.161 -175.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -74.97 4.14 7.11 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.613 1.565 . . . . 0.0 112.341 176.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 58.56 21.77 9.01 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 128.419 2.687 . . . . 0.0 113.517 175.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -101.65 170.54 8.11 Favored 'General case' 0 C--O 1.232 0.17 0 C-N-CA 123.971 0.908 . . . . 0.0 110.259 163.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 62.2 m95 -103.16 95.47 6.14 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 171.058 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 60.5 t60 -69.13 144.51 95.38 Favored Pre-proline 0 CA--C 1.54 0.572 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 178.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -69.82 106.48 1.68 Allowed 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 123.788 2.992 . . . . 0.0 111.386 178.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -81.51 37.28 0.45 Allowed 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.59 1.556 . . . . 0.0 111.895 -177.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 69.79 165.05 0.13 Allowed Pre-proline 0 CA--C 1.541 0.611 0 C-N-CA 128.364 2.666 . . . . 0.0 112.751 -173.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -74.44 168.23 25.3 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 121.336 1.357 . . . . 0.0 110.06 166.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 21.6 tp -121.33 144.3 39.6 Favored Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 124.622 1.169 . . . . 0.0 108.817 -176.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.89 167.48 27.11 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.708 2.272 . . . . 0.0 110.76 172.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -66.46 -35.09 31.78 Favored 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 120.791 0.994 . . . . 0.0 111.491 -175.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -67.48 -27.11 66.74 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.886 1.274 . . . . 0.0 110.731 174.119 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -69.49 -29.61 71.5 Favored Glycine 0 N--CA 1.444 -0.788 0 CA-C-O 119.351 -0.694 . . . . 0.0 111.655 -173.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 21.1 tp -51.52 -47.42 63.33 Favored 'General case' 0 C--N 1.342 0.251 0 CA-C-N 117.683 0.741 . . . . 0.0 110.158 170.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -58.62 -30.64 67.42 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-O 117.259 -1.353 . . . . 0.0 111.384 -173.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 60.8 m-20 -57.68 -37.06 72.8 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 120.302 1.41 . . . . 0.0 111.279 176.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -71.42 -62.14 1.52 Allowed 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 -178.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.429 HD12 HD11 ' A' ' 109' ' ' LEU . 15.9 mm -59.47 -28.12 38.99 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 122.991 0.517 . . . . 0.0 111.671 -174.25 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.5 mtm180 -48.65 -40.59 28.44 Favored 'General case' 0 C--N 1.338 0.096 0 C-N-CA 124.924 1.29 . . . . 0.0 111.619 171.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.48 -61.41 2.46 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.446 1.098 . . . . 0.0 110.441 177.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.511 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 7.9 t60 -52.32 -43.89 64.8 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 125.514 1.526 . . . . 0.0 110.015 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 93.8 m -68.48 -43.62 76.56 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 121.588 -0.695 . . . . 0.0 111.86 179.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.11 -39.18 92.74 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 118.812 0.733 . . . . 0.0 111.246 -174.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 12.4 t -69.33 -11.74 61.07 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 118.189 -0.91 . . . . 0.0 111.791 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 67.2 mt -125.78 -4.44 7.03 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.71 1.604 . . . . 0.0 113.231 -176.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 73.75 20.91 79.8 Favored Glycine 0 CA--C 1.536 1.402 0 O-C-N 120.403 -1.436 . . . . 0.0 114.501 -178.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . 0.514 ' NE2' HD13 ' A' ' 112' ' ' LEU . 10.1 m-70 -63.83 161.65 15.02 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-N 119.951 1.876 . . . . 0.0 112.476 -172.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 84.4 m -81.07 -173.68 4.43 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.882 2.073 . . . . 0.0 112.921 177.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 5.4 t -152.78 139.37 18.74 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 127.196 2.199 . . . . 0.0 107.739 172.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 10.8 t -154.99 -164.55 1.82 Allowed 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.901 1.68 . . . . 0.0 109.102 -172.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 3.8 t 54.11 32.31 15.51 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 127.576 2.35 . . . . 0.0 116.911 154.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt 68.45 113.51 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 126.247 1.819 . . . . 0.0 110.361 -174.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 10.9 ttp 52.47 44.35 30.05 Favored 'General case' 0 CA--C 1.52 -0.192 0 C-N-CA 125.597 1.559 . . . . 0.0 111.852 170.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 63.73 -85.28 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.656 1.582 . . . . 0.0 107.74 -176.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -111.24 115.25 29.03 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 126.583 1.953 . . . . 0.0 109.388 172.514 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 10.7 t-160 -58.65 -28.99 66.21 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 172.314 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 18.6 m -148.86 165.15 32.37 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.458 -0.776 . . . . 0.0 110.229 -172.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 40.6 t -63.11 -35.72 72.94 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 O-C-N 121.65 -0.657 . . . . 0.0 109.873 179.314 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -40.65 88.54 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 126.495 1.918 . . . . 0.0 111.233 175.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.59 -51.02 71.19 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 178.655 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.12 -50.91 71.82 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.057 1.343 . . . . 0.0 112.794 -176.742 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 33.9 mm -55.87 -47.92 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 CA-C-N 119.938 1.245 . . . . 0.0 109.041 -175.358 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -69.66 -40.76 76.24 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 123.954 0.902 . . . . 0.0 110.105 -172.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.69 ' CE2' HD11 ' A' ' 112' ' ' LEU . 73.8 t80 -52.17 -67.08 0.28 Allowed 'General case' 0 C--O 1.224 -0.237 0 C-N-CA 125.224 1.41 . . . . 0.0 109.633 171.606 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.666 ' HA ' HD12 ' A' ' 112' ' ' LEU . 7.7 mp -45.45 -45.97 13.26 Favored 'General case' 0 C--N 1.345 0.383 0 C-N-CA 124.498 1.119 . . . . 0.0 112.08 175.027 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -62.64 -39.92 95.38 Favored 'General case' 0 C--N 1.334 -0.079 0 CA-C-O 119.207 -0.425 . . . . 0.0 112.031 -178.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -85.7 -11.25 54.18 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 118.531 0.605 . . . . 0.0 112.497 -176.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.69 HD11 ' CE2' ' A' ' 108' ' ' PHE . 45.4 mt -71.61 -38.09 70.85 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 118.932 0.787 . . . . 0.0 110.082 173.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -59.54 163.8 3.92 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.549 1.54 . . . . 0.0 109.766 173.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.664 0 CA-C-O 118.366 -1.241 . . . . 0.0 111.44 179.19 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.3 ttm . . . . . 0 N--CA 1.472 0.65 0 CA-C-O 117.413 -1.28 . . . . 0.0 111.793 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 155.12 81.78 0.03 OUTLIER Glycine 0 C--N 1.34 0.792 0 CA-C-N 120.689 1.586 . . . . 0.0 112.749 172.089 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 59.62 -168.8 0.15 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.421 1.488 . . . . 0.0 112.04 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 148.07 172.18 17.79 Favored Glycine 0 CA--C 1.528 0.852 0 C-N-CA 124.278 0.942 . . . . 0.0 111.632 177.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -83.06 16.67 2.25 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.441 -1.035 . . . . 0.0 111.589 -174.23 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.83 160.83 42.54 Favored Pre-proline 0 CA--C 1.542 0.651 0 C-N-CA 126.027 1.731 . . . . 0.0 111.558 176.403 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -83.6 80.3 2.54 Favored 'Trans proline' 0 N--CA 1.448 -1.179 0 C-N-CA 122.837 2.358 . . . . 0.0 109.204 -175.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 75.33 149.69 0.13 Allowed Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 127.12 2.168 . . . . 0.0 110.917 -176.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -93.26 -18.77 0.56 Allowed 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 122.751 2.3 . . . . 0.0 112.572 174.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.83 -18.58 65.45 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 119.162 0.892 . . . . 0.0 110.37 169.725 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 tt -67.58 132.01 46.73 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.321 0.648 . . . . 0.0 110.683 169.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 40.1 mm -120.87 99.97 8.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 C-N-CA 126.822 2.049 . . . . 0.0 108.398 -174.576 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -50.06 151.16 3.63 Favored Pre-proline 0 C--O 1.235 0.335 0 C-N-CA 124.059 0.944 . . . . 0.0 112.621 179.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -70.48 165.49 78.56 Favored 'Cis proline' 0 CA--C 1.532 0.387 0 O-C-N 122.982 0.99 . . . . 0.0 112.754 1.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.463 ' HB1' HD12 ' A' ' 51' ' ' LEU . . . -140.11 172.11 13.23 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.328 0.585 . . . . 0.0 111.809 176.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 14.7 mt -140.36 105.83 5.08 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 127.072 2.149 . . . . 0.0 107.498 -171.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 25.9 tp -77.72 152.85 33.47 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 167.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.19 84.75 1.71 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.959 1.254 . . . . 0.0 113.426 176.343 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -44.89 144.59 1.14 Allowed 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 116.012 1.856 . . . . 0.0 116.012 -166.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -76.67 85.63 3.32 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 124.981 1.312 . . . . 0.0 109.681 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 138.21 -34.85 2.09 Favored Glycine 0 CA--C 1.524 0.643 0 C-N-CA 126.426 1.965 . . . . 0.0 110.988 175.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -83.38 -20.68 33.78 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 118.371 -0.823 . . . . 0.0 113.092 -163.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 12.8 m-80 71.64 -21.43 0.21 Allowed 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 126.811 2.044 . . . . 0.0 112.511 -179.124 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -65.47 150.38 48.45 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 125.791 1.636 . . . . 0.0 111.56 173.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.2 mt -107.22 153.47 22.64 Favored 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 126.141 1.776 . . . . 0.0 109.013 171.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -118.57 86.87 30.07 Favored Pre-proline 0 CA--C 1.537 0.447 0 C-N-CA 124.992 1.317 . . . . 0.0 109.557 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -65.08 128.18 20.06 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 123.483 2.788 . . . . 0.0 110.338 178.126 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.2 mt -134.36 113.93 12.42 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 -177.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 4.1 mtt85 -64.64 -46.71 81.38 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.849 0.86 . . . . 0.0 112.419 -169.351 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.551 ' H ' ' HB2' ' A' ' 33' ' ' ASP . 43.1 p -141.48 -179.92 6.43 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.931 1.293 . . . . 0.0 109.738 -178.432 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -53.62 -36.36 61.92 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 123.705 0.802 . . . . 0.0 110.752 167.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -65.98 -30.22 70.74 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 123.241 0.616 . . . . 0.0 110.84 -179.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.551 ' HB2' ' H ' ' A' ' 30' ' ' THR . 0.3 OUTLIER -70.79 -41.22 71.93 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 123.621 0.769 . . . . 0.0 109.892 174.961 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 67.6 t-105 -60.72 -42.82 98.03 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 110.5 -0.185 . . . . 0.0 110.5 173.44 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -59.42 -38.37 80.47 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 121.175 -0.953 . . . . 0.0 110.982 174.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.62 -18.3 63.77 Favored 'General case' 0 C--O 1.227 -0.098 0 C-N-CA 125.599 1.56 . . . . 0.0 112.826 176.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -73.33 -66.49 0.68 Allowed 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 178.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 11.4 p -60.89 -28.15 68.69 Favored 'General case' 0 C--O 1.234 0.267 0 O-C-N 121.157 -0.965 . . . . 0.0 112.885 -178.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -78.35 -11.55 59.95 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 117.698 -1.144 . . . . 0.0 112.273 177.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -143.33 84.34 1.81 Allowed 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 119.822 1.192 . . . . 0.0 110.027 -174.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 75.31 110.43 0.07 Allowed 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 128.14 2.576 . . . . 0.0 109.719 -171.16 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.8 mttt -75.87 65.52 1.98 Allowed 'General case' 0 C--O 1.235 0.339 0 O-C-N 120.762 -1.211 . . . . 0.0 108.457 174.021 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.4 t-160 -48.44 134.65 15.01 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 124.493 1.117 . . . . 0.0 108.253 175.088 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.5 mp -49.64 147.96 3.23 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 123.463 0.705 . . . . 0.0 110.269 175.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 19.9 mt -133.1 126.47 31.84 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 177.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -108.85 149.1 29.6 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 126.482 1.913 . . . . 0.0 108.048 -179.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.657 ' HA ' HD13 ' A' ' 61' ' ' LEU . 57.9 m-85 -71.73 153.51 41.96 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 176.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.15 16.95 73.48 Favored Glycine 0 CA--C 1.531 1.067 0 CA-C-O 119.509 -0.606 . . . . 0.0 114.087 -173.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -59.65 -25.46 64.72 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.09 1.445 . . . . 0.0 113.283 175.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.7 ttmt 69.75 142.29 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 127.759 2.423 . . . . 0.0 111.006 -175.218 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.463 HD12 ' HB1' ' A' ' 15' ' ' ALA . 0.2 OUTLIER -123.68 146.81 47.96 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 105.497 -2.038 . . . . 0.0 105.497 165.348 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 72.5 t -135.28 143.71 36.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 106.343 -1.725 . . . . 0.0 106.343 170.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -125.3 -179.13 4.46 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.03 1.732 . . . . 0.0 111.627 -177.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.41 -19.49 65.96 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.977 1.102 . . . . 0.0 113.977 179.109 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -85.69 0.18 53.45 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 118.869 0.759 . . . . 0.0 111.065 175.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 54.78 31.7 16.07 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 126.16 1.784 . . . . 0.0 110.107 -168.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 29.6 m170 -71.23 115.21 10.11 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 120.248 -1.533 . . . . 0.0 107.151 166.276 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.2 m -77.03 147.51 36.72 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 167.186 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -135.92 159.7 40.87 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 125.014 1.325 . . . . 0.0 108.125 169.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 27.2 t -137.84 135.13 45.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 C-N-CA 129.061 2.944 . . . . 0.0 106.333 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.657 HD13 ' HA ' ' A' ' 47' ' ' TYR . 0.4 OUTLIER -78.27 140.02 38.87 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 175.127 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -113.49 161.16 17.69 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 123.259 0.624 . . . . 0.0 109.824 175.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.408 ' HA ' ' CZ ' ' A' ' 47' ' ' TYR . 2.8 mt-10 -53.15 -25.61 14.03 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.655 0.782 . . . . 0.0 112.528 -177.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.83 -12.15 2.87 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 129.404 3.082 . . . . 0.0 114.041 172.192 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 63.69 36.73 10.55 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-N 120.423 1.465 . . . . 0.0 110.851 -174.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -124.3 173.57 8.29 Favored 'General case' 0 N--CA 1.457 -0.099 0 C-N-CA 125.072 1.349 . . . . 0.0 111.161 164.375 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 70.7 m95 -115.89 121.28 41.86 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 125.074 1.35 . . . . 0.0 107.87 177.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -95.34 155.79 38.39 Favored Pre-proline 0 N--CA 1.439 -0.981 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 179.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -66.53 121.36 8.6 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 123.084 2.523 . . . . 0.0 109.094 170.64 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -108.23 40.53 1.74 Allowed 'General case' 0 C--O 1.236 0.35 0 C-N-CA 124.747 1.219 . . . . 0.0 109.987 -177.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.85 165.91 0.13 Allowed Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 127.136 2.174 . . . . 0.0 112.682 179.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -71.79 178.0 6.3 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 121.567 1.511 . . . . 0.0 111.007 166.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 15.7 tp -142.65 145.06 32.6 Favored Pre-proline 0 CA--C 1.535 0.369 0 C-N-CA 124.083 0.953 . . . . 0.0 111.648 -169.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -67.81 165.88 26.29 Favored 'Trans proline' 0 CA--C 1.536 0.617 0 C-N-CA 122.619 2.213 . . . . 0.0 113.039 176.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -61.77 -22.5 74.51 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 123.688 2.925 . . . . 0.0 113.257 173.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -86.36 -16.37 37.59 Favored 'General case' 0 C--N 1.332 -0.179 0 O-C-N 121.304 -0.872 . . . . 0.0 112.25 176.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -67.55 -32.89 79.78 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 120.537 -0.839 . . . . 0.0 111.958 179.326 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 35.8 tp -53.97 -58.62 6.63 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 118.054 0.927 . . . . 0.0 108.581 168.227 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -46.14 -37.69 7.27 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 126.52 1.928 . . . . 0.0 113.502 178.717 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -70.86 -37.21 73.08 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 124.583 1.153 . . . . 0.0 112.005 -177.518 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.2 tp -70.37 -51.45 29.72 Favored 'General case' 0 CA--C 1.521 -0.15 0 C-N-CA 124.866 1.266 . . . . 0.0 110.964 175.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 27.6 mm -57.47 -35.54 50.07 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 -177.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -46.22 -39.22 9.48 Favored 'General case' 0 C--O 1.224 -0.253 0 C-N-CA 124.798 1.239 . . . . 0.0 112.988 173.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.97 -62.27 1.98 Allowed 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 123.718 0.807 . . . . 0.0 109.599 178.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 42.8 t60 -57.7 -39.14 76.52 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.151 0.98 . . . . 0.0 110.723 -177.463 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 66.0 m -64.88 -41.12 95.89 Favored 'General case' 0 N--CA 1.448 -0.527 0 O-C-N 121.438 -0.789 . . . . 0.0 111.788 176.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.33 -38.27 81.37 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 124.493 1.117 . . . . 0.0 112.302 179.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.2 t -64.44 -40.56 95.98 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 118.895 0.77 . . . . 0.0 109.809 178.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 85.2 mt -82.11 -72.35 0.44 Allowed 'General case' 0 C--O 1.233 0.227 0 C-N-CA 123.819 0.848 . . . . 0.0 108.789 -176.108 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 143.61 42.19 0.06 OUTLIER Glycine 0 CA--C 1.525 0.7 0 C-N-CA 124.761 1.172 . . . . 0.0 111.212 -177.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 70.8 m-70 -124.52 177.57 5.86 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 124.136 0.974 . . . . 0.0 111.347 -174.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 28.5 t -145.34 -55.71 0.31 Allowed 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 123.162 1.458 . . . . 0.0 110.191 166.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 7.9 p -146.94 -177.15 5.5 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.931 -172.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 2.4 t -150.6 -42.07 0.13 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-O 118.684 -0.674 . . . . 0.0 109.416 177.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 9.2 t -131.97 -52.4 0.98 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-N 118.987 0.812 . . . . 0.0 112.423 -168.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 17.3 ptmt -147.39 97.34 2.84 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 119.684 1.129 . . . . 0.0 110.987 -174.111 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 5.3 tmm? 51.0 -157.75 0.1 Allowed 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 -171.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.08 -67.1 0.28 Allowed 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 171.706 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.634 HD13 ' HB2' ' A' ' 105' ' ' ALA . 97.1 mt -149.41 153.25 37.07 Favored 'General case' 0 CA--C 1.511 -0.522 0 C-N-CA 126.476 1.91 . . . . 0.0 109.279 -174.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 26.2 t-80 -76.32 -47.09 24.77 Favored 'General case' 0 N--CA 1.444 -0.728 0 C-N-CA 124.407 1.083 . . . . 0.0 112.018 167.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 53.9 m -170.14 179.11 3.62 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 125.461 1.504 . . . . 0.0 111.154 -171.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 63.8 t -66.47 -42.97 91.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 CA-C-N 119.602 1.092 . . . . 0.0 111.089 -174.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 4.4 tpt -56.83 -46.77 81.48 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 118.714 0.688 . . . . 0.0 109.405 -179.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -58.53 -36.84 74.48 Favored 'General case' 0 C--N 1.339 0.147 0 C-N-CA 124.143 0.977 . . . . 0.0 110.194 177.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.634 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -64.62 -45.73 85.63 Favored 'General case' 0 C--O 1.227 -0.131 0 C-N-CA 123.418 0.687 . . . . 0.0 111.929 178.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 30.1 mm -59.03 -47.78 88.82 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 -177.019 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -75.82 -32.04 59.65 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 118.834 -0.603 . . . . 0.0 111.31 -177.328 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -60.18 -56.4 22.02 Favored 'General case' 0 C--N 1.342 0.25 0 C-N-CA 123.922 0.889 . . . . 0.0 110.202 173.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 25.3 mt -57.6 -43.25 84.55 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -175.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -68.86 -7.69 36.87 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 175.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -107.03 -7.95 16.74 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 119.817 1.19 . . . . 0.0 112.601 176.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . 0.293 1.3 tp -98.13 -46.56 5.81 Favored 'General case' 0 N--CA 1.416 -2.151 0 C-N-CA 126.472 1.909 . . . . 0.0 109.063 -177.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.44 158.7 5.45 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 124.747 1.219 . . . . 0.0 113.805 -156.456 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.242 0 CA-C-O 118.016 -1.435 . . . . 0.0 110.453 171.702 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 42.0 mmm . . . . . 0 N--CA 1.472 0.63 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 133.44 88.48 0.35 Allowed Glycine 0 C--N 1.338 0.671 0 N-CA-C 110.914 -0.875 . . . . 0.0 110.914 172.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -98.44 97.72 9.02 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.758 0.823 . . . . 0.0 110.142 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -172.88 -27.17 0.02 OUTLIER Glycine 0 CA--C 1.525 0.715 0 CA-C-O 119.516 -0.602 . . . . 0.0 113.346 171.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -117.49 15.32 14.67 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 125.338 1.455 . . . . 0.0 110.111 177.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 6.8 p -130.55 153.68 81.5 Favored Pre-proline 0 C--O 1.239 0.518 0 C-N-CA 125.517 1.527 . . . . 0.0 110.572 -162.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -68.18 -55.37 0.25 Allowed 'Trans proline' 0 N--CA 1.45 -1.081 0 C-N-CA 121.699 1.599 . . . . 0.0 110.842 169.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -140.45 153.88 68.91 Favored Pre-proline 0 CA--C 1.542 0.65 0 C-N-CA 126.949 2.1 . . . . 0.0 108.481 177.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -85.25 -17.94 4.32 Favored 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 122.75 2.3 . . . . 0.0 113.513 173.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -78.82 -17.61 55.41 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 118.905 0.775 . . . . 0.0 112.278 -179.054 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.405 HD12 ' HB3' ' A' ' 53' ' ' ASP . 0.6 OUTLIER -66.99 135.22 53.42 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.455 0.702 . . . . 0.0 111.013 165.224 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 47.9 mm -123.07 108.02 20.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 C-N-CA 127.27 2.228 . . . . 0.0 106.892 176.483 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 56.6 m95 -52.6 151.99 7.19 Favored Pre-proline 0 C--O 1.238 0.473 0 C-N-CA 124.68 1.192 . . . . 0.0 111.644 -179.215 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -69.69 169.44 63.06 Favored 'Cis proline' 0 N--CA 1.457 -0.658 0 N-CA-C 115.411 1.274 . . . . 0.0 115.411 -0.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.78 171.23 14.71 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.596 1.159 . . . . 0.0 111.392 -175.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -146.53 102.78 3.61 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.514 1.125 . . . . 0.0 111.04 -165.303 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.9 tp -78.32 150.32 33.3 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 123.35 0.66 . . . . 0.0 109.23 177.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.401 ' O ' ' HE2' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -150.7 84.98 1.36 Allowed 'General case' 0 C--O 1.237 0.416 0 CA-C-N 119.082 0.855 . . . . 0.0 110.574 174.404 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -59.76 158.59 10.11 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 123.565 0.746 . . . . 0.0 110.762 -167.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -67.22 125.33 25.72 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 122.836 1.303 . . . . 0.0 111.135 178.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 85.75 -31.96 3.82 Favored Glycine 0 CA--C 1.528 0.871 0 C-N-CA 125.692 1.615 . . . . 0.0 111.904 178.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 39.4 m -68.14 169.19 10.7 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 118.448 1.124 . . . . 0.0 110.077 170.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -141.1 -16.4 0.85 Allowed 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 125.265 1.426 . . . . 0.0 111.958 -175.021 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -71.03 105.94 3.51 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 175.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.474 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 3.9 mm? -60.37 137.86 58.07 Favored 'General case' 0 N--CA 1.462 0.162 0 N-CA-C 106.903 -1.518 . . . . 0.0 106.903 171.498 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.56 88.12 8.9 Favored Pre-proline 0 C--N 1.33 -0.261 0 C-N-CA 125.308 1.443 . . . . 0.0 107.864 -174.648 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -62.54 132.06 36.39 Favored 'Trans proline' 0 CA--C 1.541 0.829 0 C-N-CA 123.208 2.605 . . . . 0.0 109.994 176.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -119.4 118.05 30.13 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 106.105 -1.813 . . . . 0.0 106.105 168.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 72.7 mtm180 -75.03 -47.02 31.11 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 -174.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 67.4 p -135.59 178.59 6.92 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.815 0.846 . . . . 0.0 110.903 -179.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -60.03 -39.5 86.12 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.452 -0.78 . . . . 0.0 109.582 175.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -56.66 -23.81 44.17 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.459 1.104 . . . . 0.0 111.371 176.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -93.86 -32.51 13.9 Favored 'General case' 0 N--CA 1.454 -0.272 0 O-C-N 120.756 -1.215 . . . . 0.0 111.058 -172.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 11.0 t-105 -58.06 -42.83 86.3 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 165.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -53.53 -60.29 3.5 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 172.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.467 ' HA ' ' HB3' ' A' ' 39' ' ' ALA . 0.0 OUTLIER -71.42 -25.78 62.48 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 117.556 -1.658 . . . . 0.0 110.204 -163.546 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 31.2 t80 -53.63 -51.01 64.45 Favored 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 123.23 0.612 . . . . 0.0 110.022 175.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 31.6 p -93.71 -5.63 48.05 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -174.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.467 ' HB3' ' HA ' ' A' ' 36' ' ' ARG . . . -71.51 -5.18 31.25 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 127.832 2.453 . . . . 0.0 112.488 163.684 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -145.49 116.1 7.66 Favored 'General case' 0 N--CA 1.436 -1.163 0 N-CA-C 104.484 -2.414 . . . . 0.0 104.484 -165.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.0 t -49.06 95.18 0.01 OUTLIER 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 126.611 1.964 . . . . 0.0 109.956 178.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.2 mmtp -132.04 -76.77 0.51 Allowed 'General case' 0 CA--C 1.518 -0.255 0 C-N-CA 125.38 1.472 . . . . 0.0 107.702 -173.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -138.09 160.08 40.33 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 -172.462 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.555 HD22 ' H ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -111.18 122.37 47.71 Favored 'General case' 0 CA--C 1.513 -0.451 0 C-N-CA 125.146 1.378 . . . . 0.0 108.985 -160.723 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 48.5 mt -75.48 128.54 35.55 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -142.78 163.61 32.34 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 125.941 1.696 . . . . 0.0 107.54 -178.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.481 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 20.6 m-85 -55.95 138.23 49.2 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.77 0.795 . . . . 0.0 110.67 -179.108 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.28 7.69 76.15 Favored Glycine 0 CA--C 1.536 1.384 0 CA-C-O 118.096 -1.391 . . . . 0.0 114.244 179.181 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.97 -27.17 61.02 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 119.716 1.758 . . . . 0.0 115.483 -170.487 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.476 ' H ' HG23 ' A' ' 60' ' ' VAL . 22.0 ttmt 57.62 152.2 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 130.38 3.472 . . . . 0.0 115.791 174.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.4 tp -141.19 155.58 46.04 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 174.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 97.0 t -130.58 155.43 41.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 105.105 -2.183 . . . . 0.0 105.105 157.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.405 ' HB3' HD12 ' A' ' 11' ' ' LEU . 2.0 p-10 -123.5 -179.74 4.45 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 126.521 1.928 . . . . 0.0 111.76 176.512 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.5 m -68.55 -17.12 64.08 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 114.857 1.428 . . . . 0.0 114.857 177.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -77.36 -7.81 56.68 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 120.433 1.469 . . . . 0.0 111.27 168.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 64.66 32.28 11.44 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.885 1.274 . . . . 0.0 110.713 -167.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 54.1 m170 -83.61 110.3 18.13 Favored 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 166.398 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.5 m -79.67 149.18 31.33 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 169.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -146.64 164.81 31.49 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 125.448 1.499 . . . . 0.0 110.623 176.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.476 HG23 ' H ' ' A' ' 50' ' ' LYS . 7.6 p -153.72 150.89 11.97 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 CA-C-N 120.372 1.442 . . . . 0.0 113.871 170.028 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.433 HD12 ' O ' ' A' ' 66' ' ' HIS . 38.6 tp -72.19 135.62 46.17 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.744 2.017 . . . . 0.0 109.301 176.34 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -116.25 -179.74 3.76 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.313 1.045 . . . . 0.0 109.27 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.481 ' HA ' ' CE1' ' A' ' 47' ' ' TYR . 14.7 mp0 -60.32 -20.96 61.34 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.885 1.274 . . . . 0.0 113.826 -177.305 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -90.91 16.44 9.45 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.416 1.086 . . . . 0.0 112.552 -173.277 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 61.38 -0.57 0.36 Allowed 'General case' 0 C--O 1.239 0.547 0 C-N-CA 126.855 2.062 . . . . 0.0 114.075 -172.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.433 ' O ' HD12 ' A' ' 61' ' ' LEU . 0.9 OUTLIER -82.29 171.99 13.62 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 118.864 0.756 . . . . 0.0 111.164 176.379 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.416 ' CE2' ' HB2' ' A' ' 61' ' ' LEU . 26.2 m95 -115.57 147.14 41.07 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 168.748 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -134.55 162.87 55.13 Favored Pre-proline 0 CA--C 1.532 0.256 0 C-N-CA 125.272 1.429 . . . . 0.0 111.272 -169.013 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -72.19 133.15 20.68 Favored 'Trans proline' 0 CA--C 1.535 0.548 0 C-N-CA 123.5 2.8 . . . . 0.0 112.587 -176.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -114.46 29.52 7.96 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.999 1.32 . . . . 0.0 111.432 175.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 70.05 165.35 0.13 Allowed Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 127.615 2.366 . . . . 0.0 111.899 -178.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -70.43 173.01 12.2 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 121.207 1.271 . . . . 0.0 110.259 168.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 12.6 tp -127.19 144.29 50.09 Favored Pre-proline 0 CA--C 1.533 0.322 0 CA-C-O 117.755 -1.117 . . . . 0.0 108.569 -178.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -76.02 169.36 22.27 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 122.761 2.307 . . . . 0.0 110.19 173.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -63.02 -30.31 76.15 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 121.889 1.726 . . . . 0.0 112.918 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -82.1 -21.52 36.71 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 119.385 0.993 . . . . 0.0 111.459 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.22 -16.28 57.72 Favored Glycine 0 CA--C 1.534 1.247 0 O-C-N 121.872 -0.518 . . . . 0.0 112.457 178.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 23.8 tp -61.04 -52.55 64.51 Favored 'General case' 0 C--O 1.232 0.148 0 C-N-CA 126.133 1.773 . . . . 0.0 109.592 172.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -71.65 -34.13 69.49 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 125.306 1.442 . . . . 0.0 109.088 -169.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -52.57 -48.44 66.19 Favored 'General case' 0 CA--C 1.516 -0.333 0 C-N-CA 126.185 1.794 . . . . 0.0 112.081 172.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 28.9 mt -65.01 -58.2 6.72 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.416 177.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.486 HD12 HD11 ' A' ' 109' ' ' LEU . 16.4 mm -58.86 -25.0 27.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.339 0 CA-C-O 118.952 -0.546 . . . . 0.0 111.984 -175.579 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 5.7 ttm180 -46.32 -40.37 11.67 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-O 117.909 -1.043 . . . . 0.0 111.523 173.104 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -67.29 -45.85 75.32 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 119.385 0.993 . . . . 0.0 112.041 -178.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.474 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 10.9 t60 -61.96 -45.43 93.68 Favored 'General case' 0 C--O 1.223 -0.3 0 C-N-CA 124.473 1.109 . . . . 0.0 109.318 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 99.1 m -69.42 -46.11 67.59 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 121.548 -0.72 . . . . 0.0 110.657 -179.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.23 -44.72 95.91 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 118.392 -0.813 . . . . 0.0 110.861 -177.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 8.4 t -67.25 -17.86 64.97 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 117.986 -1.007 . . . . 0.0 112.181 -175.198 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 83.7 mt -110.64 -35.31 6.04 Favored 'General case' 0 C--N 1.341 0.222 0 CA-C-N 119.097 0.862 . . . . 0.0 111.524 -172.593 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 115.18 17.91 6.52 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.975 1.274 . . . . 0.0 113.293 -179.33 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . 0.71 ' CE1' HD13 ' A' ' 112' ' ' LEU . 20.6 m170 -72.01 159.95 33.33 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-N 118.404 1.102 . . . . 0.0 111.556 -173.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 28.4 p -77.02 -177.15 4.3 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.628 1.971 . . . . 0.0 111.426 175.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 3.0 p -160.43 100.81 1.35 Allowed 'General case' 0 C--O 1.235 0.31 0 C-N-CA 123.533 0.733 . . . . 0.0 112.624 166.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 1.3 p -145.49 168.77 19.77 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.724 0.809 . . . . 0.0 109.643 -168.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 75.18 108.03 0.07 Allowed 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 126.253 1.821 . . . . 0.0 109.898 175.508 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.488 ' HE3' ' CD2' ' A' ' 100' ' ' HIS . 30.8 ttpt 44.36 58.7 3.64 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.183 1.393 . . . . 0.0 111.828 176.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 3.8 tpt 47.03 63.33 1.99 Allowed 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.14 1.376 . . . . 0.0 111.249 -171.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 70.98 -65.26 0.35 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.423 1.889 . . . . 0.0 113.569 176.039 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 18.4 mt -141.97 118.63 11.03 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 -161.064 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . 0.488 ' CD2' ' HE3' ' A' ' 96' ' ' LYS . 13.0 t-160 -69.76 -43.08 72.97 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 118.323 0.51 . . . . 0.0 110.941 172.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 67.5 m -145.23 166.89 24.17 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 124.337 1.055 . . . . 0.0 110.199 -164.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 70.4 t -55.35 -35.7 37.86 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 169.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 2.8 tpt -52.76 -47.48 67.43 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 125.151 1.38 . . . . 0.0 112.024 175.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -59.06 -50.86 72.48 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.86 -48.83 78.76 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 125.112 1.365 . . . . 0.0 112.83 -172.445 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 19.9 mm -58.72 -45.1 91.2 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 -176.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -67.58 -43.0 81.63 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 122.725 0.41 . . . . 0.0 111.135 -178.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 44.6 t80 -50.18 -60.1 3.29 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.429 1.091 . . . . 0.0 110.246 176.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.486 HD11 HD12 ' A' ' 82' ' ' ILE . 9.0 mp -54.77 -45.79 74.31 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 125.04 1.336 . . . . 0.0 111.933 175.026 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -61.16 -31.57 71.3 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 119.606 -0.235 . . . . 0.0 111.515 -179.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -78.16 -18.58 55.38 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.923 0.889 . . . . 0.0 112.4 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.71 HD13 ' CE1' ' A' ' 91' ' ' HIS . 47.0 mt -87.16 -43.62 12.11 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 124.955 1.302 . . . . 0.0 111.104 -177.613 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -68.53 173.02 5.38 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.303 1.041 . . . . 0.0 112.226 -178.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.211 0 N-CA-C 107.512 -2.235 . . . . 0.0 107.512 178.991 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 83.8 mmm . . . . . 0 N--CA 1.47 0.574 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 72.8 28.12 67.69 Favored Glycine 0 CA--C 1.526 0.744 0 CA-C-O 119.483 -0.621 . . . . 0.0 111.84 -179.009 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -94.41 -40.73 9.76 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 118.223 1.012 . . . . 0.0 113.002 -175.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 146.48 -161.69 28.39 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 107.759 -2.136 . . . . 0.0 107.759 -162.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -135.61 93.58 2.97 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 118.317 1.058 . . . . 0.0 109.48 175.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -127.07 164.41 35.57 Favored Pre-proline 0 N--CA 1.474 0.747 0 C-N-CA 124.989 1.316 . . . . 0.0 111.462 -178.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.45 -47.43 0.18 Allowed 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.558 2.172 . . . . 0.0 111.595 177.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 16.4 t-80 -147.62 148.14 29.91 Favored Pre-proline 0 C--O 1.235 0.311 0 C-N-CA 126.882 2.073 . . . . 0.0 106.738 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -75.91 -32.95 4.05 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 121.318 1.345 . . . . 0.0 112.843 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -84.61 -4.43 58.99 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 117.872 -1.061 . . . . 0.0 112.713 179.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 tt -66.97 127.68 33.47 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 119.786 1.176 . . . . 0.0 108.09 165.03 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 24.1 mm -115.26 119.56 62.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 -177.156 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 75.7 m95 -63.66 152.91 85.12 Favored Pre-proline 0 CA--C 1.538 0.491 0 C-N-CA 123.441 0.696 . . . . 0.0 111.749 -177.021 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -74.36 168.89 75.57 Favored 'Cis proline' 0 CA--C 1.532 0.422 0 N-CA-C 113.376 0.491 . . . . 0.0 113.376 -0.155 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -126.97 166.88 16.7 Favored 'General case' 0 CA--C 1.521 -0.151 0 C-N-CA 124.024 0.929 . . . . 0.0 111.258 178.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 12.9 mt -143.26 102.37 3.96 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 126.186 1.795 . . . . 0.0 107.051 -178.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.9 tp -78.51 138.08 38.24 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 170.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.55 91.63 2.81 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 106.608 -1.626 . . . . 0.0 106.608 170.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -55.93 147.79 18.7 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 124.005 0.816 . . . . 0.0 111.974 -174.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -73.5 97.12 2.51 Favored 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 124.731 1.212 . . . . 0.0 110.345 -178.366 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 133.76 -49.43 0.91 Allowed Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 126.282 1.896 . . . . 0.0 108.978 -177.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 35.8 m -65.41 172.96 2.87 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 124.827 1.251 . . . . 0.0 111.076 -178.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 18.0 m-80 -129.29 -31.2 2.09 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 124.736 1.215 . . . . 0.0 109.302 175.376 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -67.27 95.71 0.44 Allowed 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 128.19 2.596 . . . . 0.0 108.963 -175.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.428 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 3.1 mm? -53.36 143.61 18.5 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.734 0.813 . . . . 0.0 109.819 178.537 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.402 ' HA ' ' HD2' ' A' ' 27' ' ' PRO . 1.4 tm? -111.97 87.42 8.65 Favored Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 125.705 1.602 . . . . 0.0 108.603 173.235 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.402 ' HD2' ' HA ' ' A' ' 26' ' ' LEU . 57.6 Cg_endo -62.55 136.81 60.78 Favored 'Trans proline' 0 CA--C 1.535 0.546 1 C-N-CA 125.712 4.275 . . . . 0.0 111.75 174.164 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -124.14 114.79 20.14 Favored 'General case' 0 N--CA 1.462 0.134 0 C-N-CA 125.961 1.704 . . . . 0.0 108.244 170.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.6 mmm180 -62.35 -56.21 20.61 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 126.057 1.743 . . . . 0.0 109.995 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 61.6 p -139.05 -178.21 5.24 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 124.353 1.061 . . . . 0.0 108.621 178.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -59.67 -29.54 68.14 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.505 -0.747 . . . . 0.0 111.885 167.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -61.67 -23.44 66.09 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.68 0.792 . . . . 0.0 111.168 175.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -84.45 -46.79 11.3 Favored 'General case' 0 C--O 1.223 -0.293 0 C-N-CA 126.335 1.854 . . . . 0.0 109.754 177.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 39.0 t-105 -55.48 -38.5 69.21 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 120.776 -1.203 . . . . 0.0 110.982 175.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 4.4 mm100 -61.34 -43.07 99.49 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.599 1.16 . . . . 0.0 111.85 172.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 69.5 mtt85 -65.67 -43.67 88.61 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 118.572 -0.727 . . . . 0.0 110.988 176.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -56.09 -51.97 65.97 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.117 0.967 . . . . 0.0 110.934 -178.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 1.9 t -65.21 -32.31 73.92 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 119.937 -0.705 . . . . 0.0 110.898 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -77.11 -16.5 59.16 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 -179.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -130.71 21.82 5.04 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 120.147 1.34 . . . . 0.0 111.529 -168.188 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 4.2 m -164.59 -45.85 0.03 OUTLIER 'General case' 0 C--O 1.234 0.255 0 C-N-CA 126.083 1.753 . . . . 0.0 111.05 175.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 6.6 tmtm? 49.16 40.53 17.91 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.633 1.173 . . . . 0.0 112.673 179.206 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.26 170.28 2.38 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.37 -0.831 . . . . 0.0 111.563 176.566 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.598 ' H ' HD13 ' A' ' 44' ' ' LEU 0.301 0.0 OUTLIER -66.14 153.42 42.42 Favored 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 124.953 1.301 . . . . 0.0 112.478 169.376 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.8 mt -137.58 130.18 29.82 Favored 'General case' 0 C--O 1.24 0.563 0 N-CA-C 105.988 -1.856 . . . . 0.0 105.988 172.1 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -136.07 163.99 29.05 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 124.039 0.936 . . . . 0.0 111.591 -168.525 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.401 ' CZ ' ' HA ' ' A' ' 63' ' ' GLU . 3.0 m-85 -69.0 109.86 4.17 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 106.722 -1.584 . . . . 0.0 106.722 -172.051 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.526 ' HA2' HG13 ' A' ' 60' ' ' VAL . . . 116.18 -4.71 20.12 Favored Glycine 0 CA--C 1.528 0.879 0 CA-C-O 117.62 -1.655 . . . . 0.0 114.805 -178.177 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -68.99 -2.64 10.39 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-N 120.703 2.251 . . . . 0.0 116.164 -169.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 9.6 ttmt 51.45 119.0 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 131.56 3.944 . . . . 0.0 116.473 167.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 10.3 mt -106.78 149.27 27.51 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 107.81 -1.182 . . . . 0.0 107.81 165.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 55.4 t -131.31 148.08 32.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 104.556 -2.386 . . . . 0.0 104.556 167.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -127.79 175.3 8.43 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 131.471 3.908 . . . . 0.0 110.36 -169.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.0 p -58.71 -35.19 72.26 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.803 0.841 . . . . 0.0 112.896 -179.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 40.6 m-20 -83.02 -0.43 48.85 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.657 1.583 . . . . 0.0 113.49 -176.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 62.64 22.06 13.09 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 120.028 1.286 . . . . 0.0 111.38 -177.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 34.7 m170 -71.02 103.85 2.82 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 119.85 -1.781 . . . . 0.0 110.086 160.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.07 146.44 54.18 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 120.108 1.322 . . . . 0.0 107.682 171.113 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -134.3 149.25 50.88 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 124.629 1.172 . . . . 0.0 108.091 174.39 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.526 HG13 ' HA2' ' A' ' 48' ' ' GLY . 37.1 t -137.01 140.11 43.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 C-N-CA 126.798 2.039 . . . . 0.0 106.915 175.587 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 27.9 tp -72.0 138.95 48.33 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 125.738 1.615 . . . . 0.0 107.995 173.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -109.86 168.94 9.05 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 124.32 1.048 . . . . 0.0 110.292 178.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.401 ' HA ' ' CZ ' ' A' ' 47' ' ' TYR . 16.4 mp0 -60.27 -37.65 81.12 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.866 0.867 . . . . 0.0 110.571 178.357 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -73.48 10.66 0.97 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.95 1.3 . . . . 0.0 113.264 176.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 74.14 7.58 4.72 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 127.803 2.441 . . . . 0.0 114.532 164.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -92.17 168.3 11.45 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.55 1.14 . . . . 0.0 110.296 170.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 58.5 m95 -105.13 96.84 6.8 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 108.177 -1.045 . . . . 0.0 108.177 175.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 53.4 t-80 -69.88 144.39 93.2 Favored Pre-proline 0 CA--C 1.543 0.708 0 CA-C-N 118.013 0.369 . . . . 0.0 110.006 179.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -69.4 103.03 1.04 Allowed 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 124.49 3.46 . . . . 0.0 111.262 171.536 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -83.45 37.01 0.55 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.293 1.837 . . . . 0.0 112.395 -178.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 67.59 165.28 0.12 Allowed Pre-proline 0 CA--C 1.546 0.809 0 C-N-CA 128.002 2.521 . . . . 0.0 112.716 178.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -72.71 174.65 11.42 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 121.526 1.484 . . . . 0.0 113.176 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.6 tt -131.49 143.73 50.42 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 127.157 2.183 . . . . 0.0 108.406 -168.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -89.43 166.47 5.29 Favored 'Trans proline' 0 CA--C 1.538 0.725 0 C-N-CA 124.065 3.177 . . . . 0.0 112.396 -178.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -58.19 -19.58 42.59 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.898 2.399 . . . . 0.0 113.93 178.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -101.56 -17.41 16.4 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 124.127 0.971 . . . . 0.0 111.086 -177.025 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.53 -40.37 98.67 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.135 -1.186 . . . . 0.0 110.135 174.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 54.6 tp -60.83 -50.21 74.35 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 179.018 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -63.61 -19.64 65.02 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.638 1.175 . . . . 0.0 111.793 -177.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -77.43 -47.13 20.54 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 119.696 1.135 . . . . 0.0 110.793 170.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 29.4 mt -57.63 -54.46 46.58 Favored 'General case' 0 N--CA 1.466 0.367 0 O-C-N 121.807 -0.558 . . . . 0.0 110.305 174.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 20.2 mm -58.11 -33.1 45.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 C-N-CA 125.084 1.354 . . . . 0.0 110.443 -178.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.86 -33.73 37.63 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 119.081 0.855 . . . . 0.0 111.729 174.369 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.4 -54.43 40.43 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 119.159 0.89 . . . . 0.0 110.472 -177.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.442 ' HE2' HD12 ' A' ' 112' ' ' LEU . 8.6 t60 -64.15 -39.33 93.8 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.478 0.711 . . . . 0.0 109.941 179.072 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 80.6 m -70.2 -40.82 74.37 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 121.327 -0.858 . . . . 0.0 111.405 -178.015 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -75.92 -31.06 58.96 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 118.925 0.784 . . . . 0.0 111.884 -177.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.8 t -66.1 -40.67 90.95 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 176.2 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 98.0 mt -81.16 -70.7 0.51 Allowed 'General case' 0 C--N 1.341 0.238 0 CA-C-O 118.596 -0.716 . . . . 0.0 109.256 -176.294 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 153.2 39.63 0.02 OUTLIER Glycine 0 CA--C 1.53 0.989 0 CA-C-O 118.572 -1.127 . . . . 0.0 113.768 171.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -107.14 156.33 18.93 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 118.938 1.369 . . . . 0.0 111.841 -172.035 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 22.5 p -147.03 35.06 0.9 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.288 1.035 . . . . 0.0 113.704 -166.422 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 5.1 p 58.89 174.62 0.07 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 131.472 3.909 . . . . 0.0 111.357 -171.116 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 18.6 p -128.15 -59.23 1.18 Allowed 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.268 -0.895 . . . . 0.0 110.711 -177.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 5.1 t -147.99 15.49 1.06 Allowed 'General case' 0 C--O 1.233 0.188 0 O-C-N 120.996 -1.065 . . . . 0.0 113.207 -173.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.579 ' HE3' ' HB2' ' A' ' 100' ' ' HIS . 0.7 OUTLIER -141.94 178.33 7.59 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.155 0.982 . . . . 0.0 109.611 177.888 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.417 ' CE ' ' H ' ' A' ' 97' ' ' MET . 0.0 OUTLIER -74.98 76.84 2.19 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 126.137 1.775 . . . . 0.0 106.83 176.484 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 58.72 -67.44 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.588 1.155 . . . . 0.0 110.133 -155.648 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.638 HD13 ' HB2' ' A' ' 105' ' ' ALA . 81.3 mt -144.47 171.24 14.63 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 128.385 2.674 . . . . 0.0 110.126 -157.063 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . 0.579 ' HB2' ' HE3' ' A' ' 96' ' ' LYS . 29.7 t-80 -106.48 -27.16 11.08 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 126.217 1.807 . . . . 0.0 112.156 176.158 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 3.0 m -172.86 172.79 3.96 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.139 1.376 . . . . 0.0 111.392 -172.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 34.7 t -66.56 -44.66 89.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 175.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 51.2 tpp -56.99 -40.11 75.95 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.398 -0.814 . . . . 0.0 111.506 178.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -69.11 -31.33 69.95 Favored 'General case' 0 C--O 1.233 0.195 0 O-C-N 122.17 -0.331 . . . . 0.0 110.85 179.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.638 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -64.24 -46.87 81.88 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.656 1.182 . . . . 0.0 110.043 173.042 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 42.4 mm -56.68 -37.45 52.9 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.215 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 176.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.46 -47.35 61.03 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 119.331 0.968 . . . . 0.0 111.399 177.176 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -54.41 -55.2 31.14 Favored 'General case' 0 N--CA 1.461 0.083 0 C-N-CA 125.563 1.545 . . . . 0.0 111.57 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 63.7 mt -62.72 -34.86 78.04 Favored 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 124.527 1.131 . . . . 0.0 110.721 -173.218 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -74.18 -44.22 54.28 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 124.293 1.037 . . . . 0.0 110.251 -176.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -64.88 2.5 0.7 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.608 1.563 . . . . 0.0 114.2 178.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.442 HD12 ' HE2' ' A' ' 85' ' ' HIS . 69.7 mt -79.93 -22.02 43.2 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 124.216 1.006 . . . . 0.0 112.1 169.179 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -86.06 95.95 9.7 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 121.715 0.769 . . . . 0.0 109.799 -174.058 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.399 0 N-CA-C 108.787 -1.725 . . . . 0.0 108.787 158.262 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.474 0.738 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -157.38 -86.96 0.06 OUTLIER Glycine 0 C--N 1.337 0.622 0 CA-C-N 119.405 1.002 . . . . 0.0 111.617 -170.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 58.69 178.32 0.07 Allowed 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 127.205 2.202 . . . . 0.0 114.214 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 86.02 -83.27 1.62 Allowed Glycine 0 CA--C 1.524 0.617 0 O-C-N 121.381 -0.825 . . . . 0.0 112.859 167.162 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -149.98 4.4 0.55 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 115.774 1.768 . . . . 0.0 115.774 -165.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -143.84 160.59 49.59 Favored Pre-proline 0 C--N 1.308 -1.234 0 C-N-CA 126.765 2.026 . . . . 0.0 109.561 168.046 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -67.72 -49.27 1.18 Allowed 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.685 2.257 . . . . 0.0 112.002 175.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . 0.409 ' HD1' ' HB2' ' A' ' 10' ' ' GLN . 4.5 t-80 -158.77 144.88 12.41 Favored Pre-proline 0 CA--C 1.534 0.332 0 CA-C-O 117.645 -1.169 . . . . 0.0 110.81 -175.195 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -72.24 -20.58 24.43 Favored 'Trans proline' 0 CA--C 1.534 0.486 0 C-N-CA 123.157 2.571 . . . . 0.0 112.96 175.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.409 ' HB2' ' HD1' ' A' ' 8' ' ' HIS . 25.9 mt-30 -85.03 -9.4 58.05 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.282 -0.886 . . . . 0.0 111.9 176.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.3 tt -78.67 132.21 36.95 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 123.957 0.903 . . . . 0.0 109.713 170.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 24.1 mm -120.53 114.11 42.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 176.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -56.5 153.8 19.28 Favored Pre-proline 0 C--O 1.238 0.456 0 CA-C-O 118.874 -0.584 . . . . 0.0 111.642 178.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -68.56 172.16 45.33 Favored 'Cis proline' 0 CA--C 1.535 0.563 0 N-CA-C 114.195 0.806 . . . . 0.0 114.195 -1.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -136.2 171.63 14.19 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.521 0.728 . . . . 0.0 112.132 176.105 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 14.5 mt -143.38 108.32 4.93 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 127.555 2.342 . . . . 0.0 106.901 -177.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.6 tp -83.3 148.38 27.4 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 170.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.66 90.26 1.91 Allowed 'General case' 0 C--O 1.238 0.499 0 CA-C-N 119.739 1.154 . . . . 0.0 109.759 171.07 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.425 HE21 ' CG ' ' A' ' 49' ' ' ASP . 4.8 mt-30 -48.98 152.48 1.05 Allowed 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 125.687 1.595 . . . . 0.0 111.932 -172.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -70.16 -11.18 60.71 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.835 0.68 . . . . 0.0 112.835 173.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -95.79 -17.66 34.86 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 124.995 1.283 . . . . 0.0 113.57 -178.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 1.3 m -129.81 -176.48 3.93 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 119.254 1.527 . . . . 0.0 110.583 -171.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -132.21 -19.47 2.5 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 126.352 1.861 . . . . 0.0 110.612 -176.004 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -67.68 155.36 39.39 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 167.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.3 mt -102.0 165.11 11.35 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 125.079 1.352 . . . . 0.0 108.937 172.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -118.19 88.33 32.11 Favored Pre-proline 0 C--N 1.328 -0.346 0 C-N-CA 125.774 1.63 . . . . 0.0 108.468 171.413 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -62.2 128.59 24.37 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 122.682 2.255 . . . . 0.0 110.225 173.039 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -120.56 109.07 14.82 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.15 1.38 . . . . 0.0 108.056 172.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 79.0 mtm180 -66.14 -47.79 72.91 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 125.344 1.458 . . . . 0.0 113.048 -173.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.14 168.11 22.44 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 126.351 1.86 . . . . 0.0 106.508 -177.468 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 -53.56 -33.28 54.15 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 126.24 1.816 . . . . 0.0 113.628 -176.125 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -56.53 -35.29 67.92 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.49 1.516 . . . . 0.0 111.575 175.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -66.67 -47.27 73.01 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.264 1.826 . . . . 0.0 109.891 -177.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 36.1 t-105 -61.88 -41.27 97.68 Favored 'General case' 0 C--N 1.345 0.38 0 O-C-N 120.771 -1.206 . . . . 0.0 110.719 176.264 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -59.56 -54.79 42.51 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 175.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 61.7 mtp180 -56.71 -34.39 67.42 Favored 'General case' 0 C--O 1.226 -0.147 0 CA-C-O 117.656 -1.164 . . . . 0.0 112.408 179.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -54.15 -68.61 0.17 Allowed 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 119.854 1.206 . . . . 0.0 110.75 177.228 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -73.31 -10.24 59.54 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 120.049 1.295 . . . . 0.0 111.317 -178.478 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -68.36 -45.75 71.95 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.887 1.222 . . . . 0.0 109.918 167.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -105.28 -16.07 14.87 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 -169.239 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.2 t -151.94 80.81 1.27 Allowed 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 127.928 2.491 . . . . 0.0 107.092 -168.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -75.76 59.68 1.22 Allowed 'General case' 0 N--CA 1.465 0.282 0 O-C-N 121.168 -0.957 . . . . 0.0 109.907 173.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -56.11 150.5 13.84 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 125.736 1.614 . . . . 0.0 108.807 173.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -56.28 129.78 41.77 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.778 1.631 . . . . 0.0 109.302 174.541 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 36.1 mt -118.58 139.48 51.41 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 125.241 1.416 . . . . 0.0 108.239 176.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -144.83 150.38 37.03 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 121.85 0.833 . . . . 0.0 110.647 -166.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.423 ' CE1' ' HA ' ' A' ' 63' ' ' GLU . 3.4 m-85 -62.13 130.1 43.88 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 173.508 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 100.55 5.87 53.54 Favored Glycine 0 CA--C 1.527 0.833 0 CA-C-O 118.441 -1.199 . . . . 0.0 114.301 -176.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.425 ' CG ' HE21 ' A' ' 19' ' ' GLN . 5.4 m-20 -75.71 -6.76 52.07 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 115.905 1.817 . . . . 0.0 115.905 -166.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 16.2 ttmt 53.07 130.71 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 130.238 3.415 . . . . 0.0 116.692 173.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 5.9 tp -122.02 154.76 36.83 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 175.402 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 41.0 t -138.04 131.6 41.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 C-N-CA 126.587 1.955 . . . . 0.0 107.0 175.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -107.14 -178.75 3.73 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.446 1.498 . . . . 0.0 113.41 178.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.436 ' HA ' HG21 ' A' ' 102' ' ' VAL . 8.6 t -56.72 -13.94 2.91 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 128.385 2.674 . . . . 0.0 115.103 177.596 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -122.69 11.87 9.84 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 126.823 2.049 . . . . 0.0 109.733 -173.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 66.96 16.43 10.36 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.895 1.678 . . . . 0.0 110.589 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 25.0 m170 -61.45 108.53 0.96 Allowed 'General case' 0 C--O 1.24 0.565 0 CA-C-N 120.363 1.438 . . . . 0.0 107.995 168.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -82.29 149.42 27.8 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 173.556 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -138.55 164.49 29.3 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 171.087 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 25.6 t -133.27 138.78 50.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 C-N-CA 128.087 2.555 . . . . 0.0 106.425 172.188 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 16.0 tp -80.16 137.32 36.68 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 171.155 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -121.84 170.91 9.31 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.38 1.072 . . . . 0.0 110.371 174.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.625 ' H ' ' CD ' ' A' ' 63' ' ' GLU . 0.7 OUTLIER -66.99 -18.57 65.45 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.584 1.553 . . . . 0.0 111.433 -171.086 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -78.16 16.45 0.76 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.903 1.281 . . . . 0.0 110.958 172.229 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 61.45 0.97 0.5 Allowed 'General case' 0 C--O 1.239 0.549 0 C-N-CA 129.746 3.219 . . . . 0.0 114.979 176.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 2.2 p-80 -85.12 156.49 21.03 Favored 'General case' 0 N--CA 1.437 -1.105 0 CA-C-O 121.781 0.801 . . . . 0.0 109.269 175.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 81.4 m95 -83.93 142.52 30.48 Favored 'General case' 0 N--CA 1.437 -1.077 0 N-CA-C 104.801 -2.296 . . . . 0.0 104.801 153.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 22.3 t-80 -114.1 143.99 30.76 Favored Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 171.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.78 103.3 0.98 Allowed 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 124.574 3.516 . . . . 0.0 111.058 176.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -79.6 29.91 0.24 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.705 1.602 . . . . 0.0 111.857 177.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 66.5 165.47 0.12 Allowed Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 128.156 2.583 . . . . 0.0 111.705 -173.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -63.36 170.23 8.34 Favored 'Trans proline' 0 N--CA 1.45 -1.034 0 C-N-CA 121.179 1.253 . . . . 0.0 110.864 167.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 13.4 tp -123.82 145.83 48.82 Favored Pre-proline 0 C--O 1.237 0.421 0 C-N-CA 124.519 1.127 . . . . 0.0 109.211 -174.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -61.46 158.78 34.6 Favored 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 123.33 2.686 . . . . 0.0 111.484 174.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -59.2 -27.23 84.45 Favored 'Trans proline' 0 N--CA 1.457 -0.674 0 C-N-CA 122.634 2.223 . . . . 0.0 112.398 179.159 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -96.11 -12.37 24.88 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.599 0.76 . . . . 0.0 111.102 -173.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.43 -28.12 68.37 Favored Glycine 0 CA--C 1.527 0.833 0 C-N-CA 123.807 0.718 . . . . 0.0 111.753 175.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 36.4 tp -52.95 -59.23 4.78 Favored 'General case' 0 C--N 1.34 0.158 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 165.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -62.59 -20.13 64.42 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.898 1.279 . . . . 0.0 112.13 -169.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -75.48 -44.94 41.35 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.577 1.151 . . . . 0.0 111.141 172.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 41.4 mt -61.65 -44.09 97.63 Favored 'General case' 0 C--O 1.234 0.257 0 O-C-N 121.009 -1.057 . . . . 0.0 110.08 173.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 37.0 mm -56.95 -41.52 77.02 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 123.25 0.62 . . . . 0.0 109.514 173.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -50.38 -42.83 54.0 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 124.413 1.085 . . . . 0.0 112.309 -179.18 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -67.44 -43.63 80.66 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 119.1 0.864 . . . . 0.0 110.952 -179.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 -58.68 -46.38 87.36 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 177.356 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 30.5 m -60.41 -44.31 95.84 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-O 118.361 -0.828 . . . . 0.0 111.244 175.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -71.48 -27.78 63.47 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 117.623 -1.179 . . . . 0.0 112.094 -172.072 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 8.4 t -70.86 -40.77 72.11 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 119.984 1.266 . . . . 0.0 108.872 177.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 58.8 mt -89.47 -63.5 1.28 Allowed 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 -174.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 157.7 9.57 0.05 OUTLIER Glycine 0 CA--C 1.536 1.351 0 C-N-CA 125.412 1.482 . . . . 0.0 114.428 174.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 21.6 p80 -109.31 48.58 0.87 Allowed 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 120.354 2.077 . . . . 0.0 114.237 -150.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 69.3 m -60.39 170.48 1.33 Allowed 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.062 -1.649 . . . . 0.0 111.658 179.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -49.4 150.97 1.65 Allowed 'General case' 0 C--O 1.234 0.258 0 C-N-CA 125.594 1.558 . . . . 0.0 112.463 -167.433 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 82.7 p -129.03 -38.1 1.65 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.189 -179.493 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -141.25 156.27 45.91 Favored 'General case' 0 N--CA 1.438 -1.059 0 C-N-CA 125.512 1.525 . . . . 0.0 109.455 -170.166 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . 0.316 0.0 OUTLIER 44.61 -162.98 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 127.116 2.166 . . . . 0.0 113.262 178.835 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 11.3 ptm -71.84 59.37 0.35 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.218 1.007 . . . . 0.0 110.292 167.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 67.39 -69.92 0.13 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.849 1.659 . . . . 0.0 109.658 -173.753 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.416 HD13 ' CB ' ' A' ' 105' ' ' ALA . 75.2 mt -142.67 141.3 31.84 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 126.643 1.977 . . . . 0.0 109.37 -169.246 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 9.8 t-160 -75.75 -27.22 58.01 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.063 0.545 . . . . 0.0 112.082 -174.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 11.2 p 179.69 179.56 0.49 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.191 1.396 . . . . 0.0 109.692 -174.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.436 HG21 ' HA ' ' A' ' 54' ' ' SER . 6.5 t -64.65 -45.53 95.09 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.21 0 C-N-CA 123.58 0.752 . . . . 0.0 109.054 -178.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 6.7 tpt -62.98 -32.82 74.25 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 121.727 -0.608 . . . . 0.0 110.682 -177.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.76 -37.84 70.46 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.186 0.994 . . . . 0.0 109.491 177.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.416 ' CB ' HD13 ' A' ' 99' ' ' LEU . . . -63.74 -43.15 97.35 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 125.635 1.574 . . . . 0.0 112.455 176.159 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 33.9 mm -61.26 -50.63 79.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -179.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -66.34 -39.16 89.02 Favored 'General case' 0 C--O 1.226 -0.177 0 O-C-N 123.369 0.418 . . . . 0.0 110.326 -176.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -53.91 -56.37 18.36 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 124.548 1.139 . . . . 0.0 111.117 172.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 31.7 mt -62.43 -38.78 91.04 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 111.761 0.282 . . . . 0.0 111.761 -177.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -64.87 -41.41 95.69 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 177.244 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -70.33 -13.35 62.11 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 118.111 -0.947 . . . . 0.0 113.161 -178.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 94.9 mt -60.9 -34.12 74.17 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 120.082 1.31 . . . . 0.0 110.934 172.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.23 158.87 28.81 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 125.618 1.567 . . . . 0.0 112.496 -167.207 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.018 0 C-N-CA 127.333 2.397 . . . . 0.0 107.676 167.38 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.0 mmm . . . . . 0 N--CA 1.474 0.752 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -64.16 153.43 48.25 Favored Glycine 0 CA--C 1.524 0.635 0 CA-C-O 121.328 0.405 . . . . 0.0 112.922 -175.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -151.83 163.56 38.93 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 126.059 1.744 . . . . 0.0 108.221 174.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.408 ' C ' ' H ' ' A' ' 6' ' ' THR . . . -155.45 165.52 32.44 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 107.505 -2.238 . . . . 0.0 107.505 163.6 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 43.95 3.74 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 131.065 3.746 . . . . 0.0 118.751 -170.523 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.408 ' H ' ' C ' ' A' ' 4' ' ' GLY . 0.1 OUTLIER -155.67 164.93 19.59 Favored Pre-proline 0 C--N 1.316 -0.87 1 C-N-CA 131.739 4.016 . . . . 0.0 109.188 -178.618 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -77.92 -165.08 0.31 Allowed 'Trans proline' 0 CA--C 1.548 1.185 0 C-N-CA 124.418 3.412 . . . . 0.0 111.96 179.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 26.8 t-80 -53.6 143.73 36.71 Favored Pre-proline 0 CA--C 1.539 0.541 0 C-N-CA 124.496 1.118 . . . . 0.0 110.759 -173.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -71.51 6.12 2.07 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 C-N-CA 123.907 3.071 . . . . 0.0 114.879 -177.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -125.23 -5.86 7.2 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.143 1.377 . . . . 0.0 112.317 177.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.7 tt -54.98 151.55 8.69 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 119.578 1.081 . . . . 0.0 109.931 166.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 12.6 mm -127.04 140.61 48.6 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.115 0 N-CA-C 105.928 -1.879 . . . . 0.0 105.928 174.331 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 78.9 m95 -81.04 159.96 67.04 Favored Pre-proline 0 CA--C 1.537 0.459 0 O-C-N 121.938 -0.476 . . . . 0.0 110.889 177.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.77 170.68 52.84 Favored 'Cis proline' 0 N--CA 1.455 -0.751 0 C-N-CA 124.866 -0.889 . . . . 0.0 112.621 -11.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -136.61 170.91 15.29 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.073 0.949 . . . . 0.0 111.544 -179.175 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 15.7 mt -142.68 103.38 4.21 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 127.611 2.364 . . . . 0.0 108.103 -171.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.0 tp -81.1 156.1 25.95 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 118.385 -0.817 . . . . 0.0 108.82 172.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -136.87 78.05 1.68 Allowed 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 120.321 1.419 . . . . 0.0 111.425 172.63 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -45.81 119.79 2.37 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 126.236 1.814 . . . . 0.0 110.972 -169.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.68 99.37 1.67 Allowed 'General case' 0 N--CA 1.44 -0.959 0 C-N-CA 122.958 0.503 . . . . 0.0 110.382 -164.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 132.79 -46.9 1.03 Allowed Glycine 0 CA--C 1.532 1.106 0 C-N-CA 127.743 2.592 . . . . 0.0 109.625 -173.17 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 74.9 m -68.33 -33.57 74.54 Favored 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 126.646 1.978 . . . . 0.0 114.319 -169.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.708 ' HB3' ' HB1' ' A' ' 84' ' ' ALA . 4.2 m-80 68.85 -27.04 0.15 Allowed 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 127.271 2.228 . . . . 0.0 114.422 -176.421 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -52.7 116.58 2.38 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 127.627 2.371 . . . . 0.0 109.569 169.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.669 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 4.4 mm? -73.32 136.93 44.53 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 106.908 -1.516 . . . . 0.0 106.908 168.107 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -106.73 87.07 2.58 Favored Pre-proline 0 C--O 1.239 0.529 0 C-N-CA 127.319 2.247 . . . . 0.0 108.652 -176.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -61.82 147.37 95.39 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 122.21 1.94 . . . . 0.0 109.74 176.063 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.2 mt -138.59 116.71 11.77 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 105.542 -2.021 . . . . 0.0 105.542 178.305 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 25.4 mtt-85 -82.16 -39.55 23.07 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 120.615 1.552 . . . . 0.0 114.305 -175.143 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.7 t -145.91 -177.04 5.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 120.367 1.439 . . . . 0.0 108.802 167.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.96 -25.77 58.49 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.39 1.876 . . . . 0.0 112.576 -178.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -68.24 -29.62 68.48 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.08 0.952 . . . . 0.0 111.212 173.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -70.28 -33.39 71.52 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 121.252 -0.905 . . . . 0.0 110.407 -176.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 46.1 t-105 -60.86 -32.97 72.38 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.754 -0.592 . . . . 0.0 111.35 170.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 -66.75 -42.77 85.63 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 118.474 0.579 . . . . 0.0 111.162 173.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? -54.22 -44.13 71.41 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 119.047 0.84 . . . . 0.0 110.243 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -58.2 -50.46 73.46 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-O 119.565 -0.255 . . . . 0.0 110.828 178.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 15.1 p -73.66 -14.07 61.1 Favored 'General case' 0 N--CA 1.464 0.246 0 O-C-N 119.982 -1.699 . . . . 0.0 113.32 -176.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.06 -34.62 71.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 117.614 -1.184 . . . . 0.0 111.122 166.357 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -120.68 -15.64 8.39 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 116.407 2.002 . . . . 0.0 116.407 -167.213 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 49.8 m -138.79 11.58 2.68 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 129.979 3.312 . . . . 0.0 109.994 -175.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 45.3 37.94 3.17 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 127.46 2.304 . . . . 0.0 113.458 161.057 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . 0.271 0.7 OUTLIER 48.67 30.09 2.42 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 125.002 1.321 . . . . 0.0 113.547 178.962 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.408 HD23 ' HA ' ' A' ' 44' ' ' LEU . 2.8 mt -54.37 116.15 2.48 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 106.073 -1.825 . . . . 0.0 106.073 164.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 90.3 mt -143.2 118.17 10.01 Favored 'General case' 0 C--O 1.24 0.575 0 N-CA-C 102.117 -3.29 . . . . 0.0 102.117 -176.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -118.24 160.85 20.89 Favored 'General case' 0 C--O 1.234 0.284 0 O-C-N 123.858 0.724 . . . . 0.0 110.038 -170.633 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -66.04 124.01 21.42 Favored 'General case' 0 CA--C 1.514 -0.429 0 C-N-CA 120.161 -0.616 . . . . 0.0 109.362 -164.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 103.6 0.82 46.5 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-O 117.747 -1.585 . . . . 0.0 113.821 -176.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -55.8 -29.37 59.61 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.808 1.643 . . . . 0.0 113.797 -167.652 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.419 ' HA ' ' O ' ' A' ' 59' ' ' PHE . 17.5 ttmt 54.97 155.08 0.01 OUTLIER 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 128.672 2.789 . . . . 0.0 114.889 -179.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.1 mt -141.87 140.82 32.99 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.089 174.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 99.0 t -134.05 120.87 36.74 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 125.322 1.449 . . . . 0.0 108.479 177.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 26.5 p30 -99.78 173.41 6.71 Favored 'General case' 0 C--N 1.329 -0.296 1 C-N-CA 132.018 4.127 . . . . 0.0 111.181 178.745 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.25 2.69 0.05 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.837 1.655 . . . . 0.0 114.65 174.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -123.44 5.14 9.02 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.921 1.688 . . . . 0.0 110.581 -174.342 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.45 ' CE2' ' HA ' ' A' ' 75' ' ' PRO . 11.7 m-85 61.82 14.88 6.59 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.188 1.795 . . . . 0.0 112.877 172.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 8.9 m170 -66.01 109.05 2.41 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 124.708 1.203 . . . . 0.0 109.713 163.235 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 97.4 m -72.15 140.15 48.66 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 118.168 -1.413 . . . . 0.0 108.43 166.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.419 ' O ' ' HA ' ' A' ' 50' ' ' LYS . 55.1 m-85 -124.94 159.89 30.14 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-O 117.749 -1.12 . . . . 0.0 108.76 165.663 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.449 HG12 ' HB2' ' A' ' 70' ' ' ALA . 1.6 p -150.28 153.29 10.61 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.419 0 CA-C-N 120.522 1.51 . . . . 0.0 112.402 171.674 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 17.5 tp -77.87 131.9 37.72 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 126.071 1.748 . . . . 0.0 108.727 -177.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -105.75 174.61 5.81 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 123.74 0.816 . . . . 0.0 110.479 179.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -68.89 -2.42 9.62 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.272 -0.893 . . . . 0.0 112.927 172.559 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -85.87 0.78 52.17 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 120.369 -1.457 . . . . 0.0 112.153 165.006 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 51.87 8.94 0.07 Allowed 'General case' 0 C--O 1.237 0.426 0 C-N-CA 128.104 2.562 . . . . 0.0 113.953 -164.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -77.72 174.16 11.27 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 167.55 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 74.7 m95 -114.49 136.94 52.46 Favored 'General case' 0 N--CA 1.44 -0.944 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 -179.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -118.31 144.71 35.59 Favored Pre-proline 0 N--CA 1.45 -0.472 0 C-N-CA 126.013 1.725 . . . . 0.0 110.401 -170.305 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -79.28 101.97 1.47 Allowed 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 124.697 3.598 . . . . 0.0 110.073 -178.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.449 ' HB2' HG12 ' A' ' 60' ' ' VAL . . . -83.35 24.68 0.8 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.212 1.405 . . . . 0.0 112.625 179.432 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 67.8 165.11 0.13 Allowed Pre-proline 0 CA--C 1.543 0.679 0 C-N-CA 128.836 2.854 . . . . 0.0 111.99 -178.09 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -70.54 175.38 8.82 Favored 'Trans proline' 0 N--CA 1.452 -0.956 0 C-N-CA 121.263 1.309 . . . . 0.0 111.947 175.062 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 13.4 tp -126.6 155.36 74.9 Favored Pre-proline 0 CA--C 1.539 0.549 0 C-N-CA 126.813 2.045 . . . . 0.0 108.772 -172.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -73.14 165.67 32.07 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 121.793 1.662 . . . . 0.0 110.113 164.126 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.45 ' HA ' ' CE2' ' A' ' 56' ' ' PHE . 18.5 Cg_endo -59.32 -36.41 94.63 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.544 2.163 . . . . 0.0 112.459 177.767 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -78.97 -25.29 43.47 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 122.455 0.302 . . . . 0.0 110.245 -174.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.13 -24.58 67.28 Favored Glycine 0 CA--C 1.53 1.029 0 CA-C-O 119.137 -0.813 . . . . 0.0 113.189 -174.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 23.4 tp -55.09 -46.16 75.48 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 124.832 1.253 . . . . 0.0 109.962 168.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -75.39 -15.26 60.47 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 123.603 0.761 . . . . 0.0 110.632 -168.583 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -68.36 -44.84 74.34 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.063 -1.023 . . . . 0.0 110.981 164.215 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.8 mp -58.15 -56.93 15.75 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 175.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 6.0 mm -53.19 -34.19 21.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 C-N-CA 125.059 1.344 . . . . 0.0 110.986 -178.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 12.2 ttt-85 -48.02 -38.89 18.22 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 119.381 0.992 . . . . 0.0 112.559 175.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.708 ' HB1' ' HB3' ' A' ' 23' ' ' ASN . . . -71.37 -42.96 67.77 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.373 0.988 . . . . 0.0 111.773 -179.074 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.669 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 13.5 t60 -55.24 -55.05 35.72 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.778 0.799 . . . . 0.0 109.281 170.719 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 95.1 m -68.29 -29.04 67.73 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 121.324 -0.86 . . . . 0.0 111.333 -172.13 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -78.95 -24.26 44.04 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 117.373 -1.299 . . . . 0.0 112.602 178.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.4 t -92.6 -17.75 23.97 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.914 0.779 . . . . 0.0 110.821 -177.136 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 70.1 mt -107.28 -22.35 12.63 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.581 0.752 . . . . 0.0 111.877 178.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 79.96 53.83 4.09 Favored Glycine 0 C--N 1.337 0.614 0 N-CA-C 110.913 -0.875 . . . . 0.0 110.913 -177.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . 0.421 ' CD2' HD13 ' A' ' 112' ' ' LEU . 35.3 m-70 -106.61 -36.67 6.67 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 122.969 0.508 . . . . 0.0 110.673 177.052 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 37.3 m 52.64 -164.87 0.07 Allowed 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.241 1.016 . . . . 0.0 112.187 -173.006 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 1.5 p -88.92 179.58 6.15 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 126.462 1.905 . . . . 0.0 111.672 -179.084 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 40.2 p -135.46 -77.77 0.44 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.039 1.336 . . . . 0.0 108.894 -178.171 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 69.1 m -132.9 178.71 6.67 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 126.491 1.916 . . . . 0.0 109.224 174.251 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . 0.394 0.0 OUTLIER 44.57 33.7 0.97 Allowed 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 128.321 2.648 . . . . 0.0 114.948 178.664 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 12.3 ttp 58.81 73.29 0.49 Allowed 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 125.375 1.47 . . . . 0.0 108.567 -178.314 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 7.9 m80 73.31 -75.31 0.08 Allowed 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 127.246 2.218 . . . . 0.0 111.831 -171.001 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.597 HD13 ' HB2' ' A' ' 105' ' ' ALA . 84.5 mt -150.69 154.39 37.32 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 124.519 1.128 . . . . 0.0 109.655 -159.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 16.0 t-160 -83.85 -40.01 19.2 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 124.571 1.169 . . . . 0.0 111.397 173.055 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 88.8 p -172.26 -175.36 1.4 Allowed 'General case' 0 C--O 1.236 0.351 0 C-N-CA 124.241 1.017 . . . . 0.0 110.414 -171.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 67.5 t -55.0 -45.27 76.67 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.291 0 C-N-CA 125.106 1.362 . . . . 0.0 110.329 177.641 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 2.8 ttm -62.29 -45.63 92.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 118.527 0.603 . . . . 0.0 110.113 -171.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.55 -39.8 85.18 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 124.559 1.144 . . . . 0.0 110.08 173.167 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.597 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -61.62 -53.82 51.07 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 123.691 0.796 . . . . 0.0 111.566 178.363 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 32.4 mm -53.86 -47.08 64.19 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 -178.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -60.12 -51.54 69.16 Favored 'General case' 0 CA--C 1.521 -0.153 0 C-N-CA 123.71 0.804 . . . . 0.0 111.163 -179.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.401 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 13.0 t80 -53.27 -65.13 0.62 Allowed 'General case' 0 C--O 1.221 -0.42 0 C-N-CA 126.371 1.868 . . . . 0.0 110.176 178.606 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 9.2 mp -52.29 -45.12 65.36 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 125.784 1.634 . . . . 0.0 112.015 -178.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -65.35 -33.98 77.23 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 118.668 0.667 . . . . 0.0 111.548 177.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -80.57 -18.74 47.4 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.741 0.816 . . . . 0.0 112.836 177.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.421 HD13 ' CD2' ' A' ' 91' ' ' HIS . 63.6 mt -77.56 -28.53 51.82 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 124.317 1.047 . . . . 0.0 110.98 173.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -71.69 162.51 29.33 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-O 121.649 0.738 . . . . 0.0 112.066 174.709 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.358 0 CA-C-O 122.714 1.174 . . . . 0.0 111.267 173.601 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.2 tpp . . . . . 0 N--CA 1.468 0.462 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 172.87 -64.1 0.13 Allowed Glycine 0 N--CA 1.449 -0.438 0 N-CA-C 105.796 -2.922 . . . . 0.0 105.796 -176.557 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -147.97 160.0 43.29 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 124.567 1.147 . . . . 0.0 108.016 160.379 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -96.65 -27.13 9.96 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 110.411 -1.076 . . . . 0.0 110.411 163.167 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 53.41 9.26 0.15 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.984 2.113 . . . . 0.0 114.332 -172.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.02 160.1 76.98 Favored Pre-proline 0 C--O 1.238 0.489 0 C-N-CA 128.146 2.578 . . . . 0.0 111.662 -175.391 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -71.91 70.23 2.91 Favored 'Trans proline' 0 N--CA 1.45 -1.062 0 C-N-CA 123.076 2.517 . . . . 0.0 110.089 169.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 75.55 148.09 0.12 Allowed Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 129.098 2.959 . . . . 0.0 113.432 -176.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -78.1 -28.74 4.61 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 122.688 2.259 . . . . 0.0 113.25 173.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -69.93 -22.34 63.2 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.701 1.137 . . . . 0.0 112.293 176.322 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 tt -63.77 135.56 56.74 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 166.368 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 3.0 tt -107.85 178.92 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.165 0 C-N-CA 124.286 1.035 . . . . 0.0 108.443 176.029 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 58.2 m95 -122.87 149.87 57.49 Favored Pre-proline 0 C--O 1.237 0.4 0 O-C-N 121.586 -0.696 . . . . 0.0 109.568 172.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -68.69 162.59 80.6 Favored 'Cis proline' 0 CA--C 1.542 0.917 0 N-CA-C 114.713 1.005 . . . . 0.0 114.713 -1.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.585 ' HA ' HD22 ' A' ' 16' ' ' LEU . . . -139.8 169.79 17.08 Favored 'General case' 0 CA--C 1.519 -0.219 0 C-N-CA 127.088 2.155 . . . . 0.0 110.967 -177.503 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.683 HD21 HG13 ' A' ' 102' ' ' VAL . 2.8 mm? -138.79 112.93 8.64 Favored 'General case' 0 N--CA 1.436 -1.164 0 C-N-CA 126.895 2.078 . . . . 0.0 108.597 -156.192 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 22.2 tp -99.72 151.51 21.15 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 123.772 0.67 . . . . 0.0 109.469 169.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.48 88.54 2.15 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 171.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.526 ' NE2' HE21 ' A' ' 46' ' ' GLN . 0.8 OUTLIER -52.94 138.0 31.17 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 118.195 0.452 . . . . 0.0 110.381 -171.649 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -59.02 109.92 0.93 Allowed 'General case' 0 N--CA 1.433 -1.321 0 C-N-CA 124.69 1.196 . . . . 0.0 108.364 178.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 110.09 -36.17 4.43 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 126.201 1.858 . . . . 0.0 112.825 -179.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 1.8 p -69.45 171.27 9.0 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 119.661 1.731 . . . . 0.0 109.151 177.083 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 11.5 m-80 -116.8 -16.49 10.62 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.622 -1.172 . . . . 0.0 108.883 172.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -76.83 109.59 10.75 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 124.359 1.064 . . . . 0.0 108.851 -170.286 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.466 ' H ' ' HB2' ' A' ' 85' ' ' HIS . 4.1 mm? -68.74 137.22 53.88 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 108.164 -1.051 . . . . 0.0 108.164 172.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.405 HD22 ' HA ' ' A' ' 26' ' ' LEU . 0.2 OUTLIER -107.05 88.41 3.7 Favored Pre-proline 0 C--N 1.327 -0.391 0 C-N-CA 128.844 2.858 . . . . 0.0 112.786 -170.956 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -66.39 120.79 7.96 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 122.194 1.929 . . . . 0.0 111.28 174.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -111.99 107.78 16.87 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 126.805 2.042 . . . . 0.0 106.074 168.102 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 4.4 mtt-85 -59.73 -49.55 77.29 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.093 0.557 . . . . 0.0 110.206 178.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 22.3 p -140.4 174.68 10.28 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 123.348 0.659 . . . . 0.0 109.642 178.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -56.55 -36.41 69.24 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 124.543 1.137 . . . . 0.0 111.479 178.391 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.5 -30.93 71.97 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-N 118.959 0.8 . . . . 0.0 110.177 -177.617 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -69.1 -40.6 78.3 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-N 119.43 1.014 . . . . 0.0 111.197 174.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 13.0 t-105 -56.7 -43.32 80.4 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.254 0.622 . . . . 0.0 110.514 175.128 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -62.6 -55.95 22.36 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 174.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.78 -24.72 67.02 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 124.085 0.954 . . . . 0.0 112.726 -173.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -58.49 -63.78 1.16 Allowed 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 124.6 1.16 . . . . 0.0 109.159 172.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 11.6 t -66.29 -30.83 71.33 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 118.606 0.639 . . . . 0.0 110.971 -177.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.75 -2.57 15.09 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-O 118.114 -0.946 . . . . 0.0 111.536 176.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -129.06 37.47 4.06 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.754 1.222 . . . . 0.0 111.548 169.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 32.1 t 70.86 -80.2 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.428 1.491 . . . . 0.0 110.003 -179.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 29.2 mmtm 44.35 56.25 5.08 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 126.033 1.733 . . . . 0.0 112.15 -178.525 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 69.4 -164.35 0.18 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.176 0.99 . . . . 0.0 110.31 171.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.2 mp -97.16 -175.76 3.33 Favored 'General case' 0 CA--C 1.53 0.18 0 O-C-N 121.271 -0.893 . . . . 0.0 110.368 -170.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 56.6 mt -130.35 128.12 40.81 Favored 'General case' 0 N--CA 1.456 -0.144 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 166.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.526 HE21 ' NE2' ' A' ' 19' ' ' GLN . 43.6 mt-30 -118.53 140.96 49.05 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 125.223 1.409 . . . . 0.0 108.363 -179.14 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.563 ' HA ' HD13 ' A' ' 61' ' ' LEU . 43.1 m-85 -63.79 108.99 1.58 Allowed 'General case' 0 C--O 1.234 0.259 0 N-CA-C 107.051 -1.463 . . . . 0.0 107.051 170.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 131.8 -12.58 5.36 Favored Glycine 0 CA--C 1.527 0.791 0 CA-C-O 118.919 -0.934 . . . . 0.0 112.866 -178.335 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -60.22 -10.76 4.93 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 127.134 2.173 . . . . 0.0 115.914 -166.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.6 ttmt 54.18 124.31 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 129.763 3.225 . . . . 0.0 114.786 175.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 51' ' ' LEU . 1.3 mm? -99.62 149.94 22.76 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 161.217 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 24.1 t -128.98 152.3 36.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 C-N-CA 128.327 2.651 . . . . 0.0 105.189 164.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -133.5 179.41 6.23 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.216 1.406 . . . . 0.0 110.86 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.4 m -70.28 -10.69 59.68 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 178.459 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 62.8 m-80 -85.94 -3.46 58.93 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 124.347 1.059 . . . . 0.0 111.356 170.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 60.55 23.25 12.96 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.226 1.01 . . . . 0.0 110.157 -170.22 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 49.2 m170 -75.34 114.42 13.86 Favored 'General case' 0 C--O 1.232 0.176 0 O-C-N 120.655 -1.278 . . . . 0.0 109.035 167.043 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 23.2 m -78.43 153.17 31.72 Favored 'General case' 0 C--O 1.239 0.5 0 N-CA-C 108.334 -0.988 . . . . 0.0 108.334 169.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -139.45 152.26 46.88 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.759 1.624 . . . . 0.0 107.861 171.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 63.0 t -136.29 144.25 33.52 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 127.848 2.459 . . . . 0.0 106.927 175.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.563 HD13 ' HA ' ' A' ' 47' ' ' TYR . 0.5 OUTLIER -81.02 134.41 35.67 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 127.331 2.252 . . . . 0.0 110.034 -178.493 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -109.97 168.48 9.4 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.729 1.15 . . . . 0.0 111.594 174.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -61.3 -15.09 31.92 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 120.384 -1.447 . . . . 0.0 112.876 178.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.05 -2.0 22.47 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 126.591 1.957 . . . . 0.0 112.63 171.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 74.4 -12.16 0.93 Allowed 'General case' 0 C--N 1.346 0.427 0 C-N-CA 127.009 2.124 . . . . 0.0 111.653 -175.058 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.2 p-80 -75.21 156.86 35.35 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 119.348 0.976 . . . . 0.0 112.054 177.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 65.9 m95 -104.08 96.19 6.49 Favored 'General case' 0 N--CA 1.436 -1.139 0 N-CA-C 105.211 -2.144 . . . . 0.0 105.211 174.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -81.54 161.26 62.34 Favored Pre-proline 0 C--O 1.239 0.543 0 C-N-CA 124.06 0.944 . . . . 0.0 109.847 177.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -74.34 148.95 39.28 Favored 'Trans proline' 0 N--CA 1.449 -1.095 0 C-N-CA 122.722 2.281 . . . . 0.0 109.136 -175.29 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -138.89 37.03 2.16 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.172 0.989 . . . . 0.0 110.757 -171.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 65.32 164.42 0.12 Allowed Pre-proline 0 CA--C 1.541 0.618 0 C-N-CA 129.001 2.92 . . . . 0.0 113.096 -174.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -69.97 -178.6 2.5 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 121.758 1.638 . . . . 0.0 111.699 169.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.9 tt -128.38 143.72 49.24 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 125.775 1.63 . . . . 0.0 108.858 -172.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -82.87 164.96 15.59 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.679 2.919 . . . . 0.0 111.155 -176.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -60.07 -28.32 86.78 Favored 'Trans proline' 0 CA--C 1.535 0.565 0 C-N-CA 121.612 1.542 . . . . 0.0 113.15 -178.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -84.24 -20.52 32.1 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.66 0.784 . . . . 0.0 112.731 175.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.65 -26.66 70.02 Favored Glycine 0 C--N 1.341 0.82 0 CA-C-N 119.154 0.888 . . . . 0.0 111.371 -173.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 18.5 tp -61.23 -52.3 65.35 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 126.391 1.876 . . . . 0.0 108.418 175.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -62.93 -34.95 78.54 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 123.128 0.571 . . . . 0.0 109.969 179.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.65 -32.44 73.76 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 127.055 2.142 . . . . 0.0 112.566 178.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.5 mp -67.07 -66.69 0.53 Allowed 'General case' 0 C--O 1.233 0.208 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 165.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 12.7 mm -53.65 -29.46 17.42 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 C-N-CA 125.941 1.697 . . . . 0.0 112.048 -171.103 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.7 mtp180 -44.82 -46.7 10.83 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 126.312 1.845 . . . . 0.0 110.979 173.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.74 -47.09 85.07 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.947 0.794 . . . . 0.0 111.637 179.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.466 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 7.0 t60 -59.45 -49.36 78.1 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.872 0.869 . . . . 0.0 109.822 179.547 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 84.8 m -69.17 -26.53 64.9 Favored 'General case' 0 C--N 1.329 -0.287 0 O-C-N 120.972 -1.08 . . . . 0.0 111.307 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -78.41 -14.74 59.25 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.469 1.108 . . . . 0.0 113.427 177.137 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.5 t -98.37 -16.86 19.14 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.968 0.804 . . . . 0.0 111.488 178.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 86.8 mt -109.41 -41.49 4.6 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.468 1.107 . . . . 0.0 110.84 178.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 103.83 64.8 0.69 Allowed Glycine 0 C--N 1.334 0.426 0 C-N-CA 125.093 1.33 . . . . 0.0 111.428 -178.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 10.1 m-70 -130.44 171.77 12.61 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 122.373 1.082 . . . . 0.0 111.46 177.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.8 p -146.36 160.02 42.6 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 126.101 1.76 . . . . 0.0 107.064 167.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.658 ' H ' ' CD2' ' A' ' 98' ' ' HIS 0.464 0.5 OUTLIER -122.39 158.27 30.05 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 125.697 1.599 . . . . 0.0 108.148 165.939 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 3.4 t -155.29 -44.23 0.08 Allowed 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 -179.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 15.0 m -50.43 101.38 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.466 1.507 . . . . 0.0 111.478 179.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.508 ' HE2' ' CD2' ' A' ' 100' ' ' HIS . 64.4 tttt 58.81 75.32 0.4 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.204 1.402 . . . . 0.0 110.5 -171.592 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 7.4 tpt 52.65 54.91 9.81 Favored 'General case' 0 CA--C 1.527 0.086 0 C-N-CA 126.907 2.083 . . . . 0.0 111.502 168.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . 0.658 ' CD2' ' H ' ' A' ' 93' ' ' CYS . 5.7 m80 60.06 -80.58 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 -167.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 95.3 mt -133.59 104.91 6.59 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.427 1.491 . . . . 0.0 109.186 -164.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . 0.508 ' CD2' ' HE2' ' A' ' 96' ' ' LYS . 2.0 t-80 -45.53 -40.7 8.9 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 127.877 2.471 . . . . 0.0 114.691 178.367 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 34.6 t -161.16 165.94 28.68 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 -168.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.683 HG13 HD21 ' A' ' 16' ' ' LEU . 45.5 t -61.64 -42.88 95.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 175.513 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 4.5 ttm -56.51 -44.89 81.17 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 123.752 0.821 . . . . 0.0 111.58 177.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.54 -38.42 87.1 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 110.395 -0.224 . . . . 0.0 110.395 177.865 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.98 -36.32 74.67 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 118.302 -0.856 . . . . 0.0 112.269 175.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.4 mm -57.46 -57.72 9.01 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.13 0 CA-C-N 119.389 0.995 . . . . 0.0 108.629 177.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.65 -20.97 52.88 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 118.64 0.655 . . . . 0.0 112.677 -169.416 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -55.94 -61.64 2.24 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 164.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 73.1 mt -63.57 -37.44 87.33 Favored 'General case' 0 C--O 1.232 0.141 0 C-N-CA 122.725 0.41 . . . . 0.0 110.699 -175.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -64.34 -17.6 63.86 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -176.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -100.38 -5.66 26.91 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.735 1.214 . . . . 0.0 113.462 -179.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 62.7 mt -67.57 -39.42 84.9 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.58 0.627 . . . . 0.0 110.479 173.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -74.86 169.26 18.28 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 126.434 1.894 . . . . 0.0 109.945 170.323 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.052 0 CA-C-O 117.688 -1.618 . . . . 0.0 112.371 166.704 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 ptp . . . . . 0 N--CA 1.473 0.695 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -113.25 132.1 10.44 Favored Glycine 0 CA--C 1.523 0.571 0 C-N-CA 125.68 1.61 . . . . 0.0 109.773 179.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -165.93 158.51 14.9 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 128.51 2.724 . . . . 0.0 106.194 175.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 146.05 -72.48 0.33 Allowed Glycine 0 CA--C 1.522 0.52 0 CA-C-O 119.015 -0.881 . . . . 0.0 112.206 -173.196 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -122.96 17.21 10.1 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.691 1.596 . . . . 0.0 111.308 -173.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -52.37 144.88 21.49 Favored Pre-proline 0 CA--C 1.536 0.425 0 C-N-CA 126.085 1.754 . . . . 0.0 109.297 172.458 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -64.59 -31.88 59.34 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 121.76 1.64 . . . . 0.0 111.512 -177.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -160.58 156.42 22.27 Favored Pre-proline 0 CA--C 1.538 0.503 0 CA-C-O 117.537 -1.22 . . . . 0.0 108.916 178.269 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -83.71 -25.14 2.56 Favored 'Trans proline' 0 CA--C 1.536 0.59 0 C-N-CA 122.566 2.178 . . . . 0.0 112.959 171.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -64.84 -18.71 65.37 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.55 1.068 . . . . 0.0 111.703 170.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 tt -77.81 123.24 26.48 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.161 0.984 . . . . 0.0 109.18 175.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.1 mm -123.59 108.57 21.2 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 N-CA-C 106.625 -1.62 . . . . 0.0 106.625 -179.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 82.6 m95 -53.83 155.49 5.94 Favored Pre-proline 0 C--O 1.237 0.431 0 C-N-CA 124.983 1.313 . . . . 0.0 113.427 -177.158 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -68.42 169.37 57.24 Favored 'Cis proline' 0 CA--C 1.534 0.493 0 N-CA-C 113.965 0.717 . . . . 0.0 113.965 -2.348 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -137.21 168.39 19.71 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 123.846 0.858 . . . . 0.0 110.79 177.216 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 14.3 mt -136.73 108.91 7.24 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 126.805 2.042 . . . . 0.0 107.242 -175.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.7 tp -81.01 144.36 31.84 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.633 -0.876 . . . . 0.0 108.633 174.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.15 94.06 2.41 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-N 118.571 0.623 . . . . 0.0 109.77 168.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -57.09 149.89 18.41 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 121.246 0.546 . . . . 0.0 110.328 -179.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -64.08 -10.04 19.94 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 171.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -109.06 0.5 31.52 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 125.831 1.681 . . . . 0.0 114.299 -175.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -142.82 178.41 7.67 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 120.176 1.988 . . . . 0.0 110.944 177.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.437 ' HB3' ' HB1' ' A' ' 84' ' ' ALA . 13.4 m-80 -121.66 -14.07 8.22 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 124.761 1.225 . . . . 0.0 109.163 176.39 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -65.71 117.16 7.74 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 107.467 -1.308 . . . . 0.0 107.467 175.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.546 ' HG ' HD13 ' A' ' 82' ' ' ILE . 3.6 mm? -74.41 136.83 42.39 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 106.897 -1.52 . . . . 0.0 106.897 168.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -110.34 87.03 5.8 Favored Pre-proline 0 C--O 1.237 0.399 0 C-N-CA 125.704 1.602 . . . . 0.0 108.491 -173.131 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -65.31 136.65 48.14 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 123.454 2.769 . . . . 0.0 110.049 -178.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.5 mt -132.93 98.26 4.25 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 -178.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.9 mmt85 -50.96 -44.11 60.51 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.487 1.515 . . . . 0.0 111.317 -177.095 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 14.4 t -160.9 -177.59 6.24 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 121.444 0.64 . . . . 0.0 109.385 -177.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -50.38 -38.83 44.66 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 125.537 1.535 . . . . 0.0 110.886 175.644 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -62.35 -33.02 73.9 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.941 0.897 . . . . 0.0 112.243 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.12 -40.15 75.04 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 121.393 -0.817 . . . . 0.0 109.607 174.509 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 47.6 t-105 -63.39 -34.03 76.84 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.214 0.606 . . . . 0.0 111.303 175.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -59.63 -62.24 2.03 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 169.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 13.2 mtt85 -63.27 -14.4 49.01 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 124.138 0.975 . . . . 0.0 113.548 -174.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -64.34 -76.1 0.07 Allowed 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 119.787 1.176 . . . . 0.0 108.608 174.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 1.5 m -61.64 -32.22 72.36 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 118.003 0.365 . . . . 0.0 111.443 -178.238 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.28 -4.76 35.17 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-O 116.661 -1.638 . . . . 0.0 112.243 179.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -136.24 -10.49 1.96 Allowed 'General case' 0 C--N 1.347 0.46 0 N-CA-C 116.743 2.127 . . . . 0.0 116.743 173.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 5.7 m -148.18 105.05 3.59 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 127.775 2.43 . . . . 0.0 107.139 169.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 2.1 pttt -75.51 59.7 1.13 Allowed 'General case' 0 C--O 1.232 0.154 0 C-N-CA 125.072 1.349 . . . . 0.0 108.438 173.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -52.24 148.21 6.77 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 126.341 1.856 . . . . 0.0 108.507 179.215 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.8 tt -61.23 127.66 32.62 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 106.328 -1.731 . . . . 0.0 106.328 173.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.4 mt -114.18 137.69 51.42 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 178.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 -143.54 151.57 40.39 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 124.259 1.024 . . . . 0.0 111.276 -167.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -63.81 115.94 5.29 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 168.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 118.93 -0.17 14.95 Favored Glycine 0 CA--C 1.527 0.835 0 CA-C-O 118.71 -1.05 . . . . 0.0 113.136 -173.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -65.32 -20.62 66.49 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 115.627 1.714 . . . . 0.0 115.627 -164.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 10.5 ttmt 44.49 137.08 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 131.385 3.874 . . . . 0.0 117.26 178.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 14.3 mt -125.65 161.94 26.12 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 114.804 -1.089 . . . . 0.0 109.392 167.503 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 95.2 t -132.38 151.78 35.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 105.533 -2.025 . . . . 0.0 105.533 158.319 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -125.51 -179.47 4.64 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 126.201 1.8 . . . . 0.0 110.828 179.079 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.3 m -64.69 -17.2 63.88 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 178.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 72.3 m-80 -77.03 -10.71 59.55 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 117.995 -1.002 . . . . 0.0 111.964 171.053 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 64.76 21.55 12.4 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 125.657 1.583 . . . . 0.0 111.658 -167.437 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 52.3 m170 -74.53 110.32 8.73 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 106.435 -1.691 . . . . 0.0 106.435 167.495 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 58.6 m -71.79 151.81 43.2 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 165.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 46.1 m-85 -143.33 160.67 40.1 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 126.461 1.905 . . . . 0.0 108.076 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 2.2 p -154.92 152.34 9.43 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.341 0 CA-C-N 120.741 1.609 . . . . 0.0 111.372 169.481 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 17.1 tp -77.98 144.01 37.11 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 125.396 1.478 . . . . 0.0 108.215 -179.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -120.67 168.19 11.66 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 125.559 1.544 . . . . 0.0 110.062 -172.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -59.64 -31.15 69.25 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 125.321 1.449 . . . . 0.0 110.841 178.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.2 2.87 11.95 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 123.619 0.767 . . . . 0.0 112.473 175.028 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 55.51 18.77 2.84 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 128.937 2.895 . . . . 0.0 113.755 176.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -84.82 -177.16 6.51 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 124.659 1.184 . . . . 0.0 108.549 154.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 50.6 m95 -112.31 154.54 25.54 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 171.026 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -124.7 150.85 66.68 Favored Pre-proline 0 C--O 1.236 0.374 0 C-N-CA 124.925 1.29 . . . . 0.0 110.221 175.686 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -71.24 111.79 3.17 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 123.75 2.967 . . . . 0.0 109.99 176.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.46 34.87 0.33 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.685 1.194 . . . . 0.0 110.807 171.326 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.83 166.64 0.12 Allowed Pre-proline 0 CA--C 1.545 0.785 0 C-N-CA 125.927 1.691 . . . . 0.0 112.131 -179.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -70.57 176.22 7.69 Favored 'Trans proline' 0 CA--C 1.535 0.571 0 C-N-CA 121.219 1.279 . . . . 0.0 111.076 166.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 20.6 tp -131.43 144.58 54.01 Favored Pre-proline 0 CA--C 1.536 0.441 0 C-N-CA 125.616 1.566 . . . . 0.0 109.324 -174.053 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -77.14 168.19 23.64 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 122.416 2.078 . . . . 0.0 109.555 176.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -59.05 -47.08 19.05 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 122.275 1.983 . . . . 0.0 112.367 178.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -79.16 -6.08 55.71 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 119.482 1.037 . . . . 0.0 110.108 -177.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.6 -24.45 67.92 Favored Glycine 0 CA--C 1.534 1.243 0 CA-C-O 118.841 -0.977 . . . . 0.0 112.972 164.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 25.6 tp -59.2 -48.08 82.94 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.588 1.694 . . . . 0.0 108.916 178.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -67.51 -7.5 26.3 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 125.421 1.488 . . . . 0.0 112.34 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -82.69 -34.94 27.2 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 121.148 1.795 . . . . 0.0 111.251 168.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -66.96 -70.76 0.23 Allowed 'General case' 0 N--CA 1.457 -0.114 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 178.19 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.546 HD13 ' HG ' ' A' ' 25' ' ' LEU . 34.0 mm -57.53 -21.03 15.02 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 C-N-CA 123.102 0.561 . . . . 0.0 112.219 -174.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.87 -47.84 11.13 Favored 'General case' 0 C--N 1.343 0.286 0 C-N-CA 124.3 1.04 . . . . 0.0 111.716 172.159 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.437 ' HB1' ' HB3' ' A' ' 23' ' ' ASN . . . -65.79 -48.85 70.38 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.23 0.612 . . . . 0.0 109.952 -171.66 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.526 ' HB2' ' H ' ' A' ' 25' ' ' LEU . 10.5 t60 -55.31 -49.32 72.46 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 126.036 1.734 . . . . 0.0 110.01 175.713 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 90.0 m -61.64 -46.41 89.89 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.463 179.063 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.55 -40.4 94.56 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 118.877 0.762 . . . . 0.0 112.33 -178.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.4 t -78.59 7.0 7.46 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.025 0.53 . . . . 0.0 111.753 178.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.5 mt -126.83 -21.99 3.94 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.005 -1.059 . . . . 0.0 111.35 173.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 97.9 6.8 56.91 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 126.378 1.942 . . . . 0.0 113.997 -176.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 81.3 m-70 -76.96 163.15 26.98 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-N 119.404 1.602 . . . . 0.0 110.71 -174.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 42.5 t -157.09 97.83 1.69 Allowed 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.653 1.181 . . . . 0.0 108.053 171.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 27.1 p 46.91 -167.83 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.246 1.819 . . . . 0.0 114.4 175.673 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.447 HG23 ' H ' ' A' ' 95' ' ' SER . 1.2 t -167.61 -85.36 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 105.299 -2.112 . . . . 0.0 105.299 -177.631 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . 0.447 ' H ' HG23 ' A' ' 94' ' ' THR . 2.5 m -93.06 172.36 8.36 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.587 1.155 . . . . 0.0 109.987 168.661 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . 0.43 0.0 OUTLIER 45.27 -164.91 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 128.62 2.768 . . . . 0.0 114.846 169.075 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -72.63 55.79 0.37 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 127.057 2.143 . . . . 0.0 109.167 176.3 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER 65.2 -54.1 0.33 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 127.778 2.431 . . . . 0.0 112.705 -165.684 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 95.0 mt -145.39 171.44 14.61 Favored 'General case' 0 C--O 1.225 -0.184 0 C-N-CA 127.478 2.311 . . . . 0.0 108.503 -166.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 27.2 t-80 -131.06 -29.56 1.84 Allowed 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 125.066 1.346 . . . . 0.0 110.135 -172.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 5.1 m -173.45 170.53 4.15 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.731 1.612 . . . . 0.0 108.681 -175.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 70.5 t -59.62 -44.0 92.39 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 172.149 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 3.4 tpt -47.34 -54.35 11.32 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.12 0.968 . . . . 0.0 109.377 174.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.63 -29.56 70.78 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.536 0.734 . . . . 0.0 112.184 -175.572 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -69.61 -48.67 59.29 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.553 1.141 . . . . 0.0 110.417 175.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 11.5 mm -59.74 -32.66 50.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 123.99 0.916 . . . . 0.0 109.723 178.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -69.0 -50.15 51.44 Favored 'General case' 0 C--N 1.338 0.091 0 C-N-CA 123.501 0.72 . . . . 0.0 110.437 175.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -54.84 -60.81 2.86 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 125.92 1.688 . . . . 0.0 111.105 178.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.8 mp -52.24 -40.92 62.29 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.412 1.085 . . . . 0.0 112.627 -179.242 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 20.5 m-80 -72.45 -28.54 63.0 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 118.881 0.764 . . . . 0.0 112.718 176.202 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -76.95 -27.53 54.85 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 121.353 -0.842 . . . . 0.0 111.296 177.028 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 40.5 mt -64.79 -53.43 47.06 Favored 'General case' 0 CA--C 1.522 -0.107 0 C-N-CA 123.656 0.782 . . . . 0.0 109.401 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.28 136.57 57.37 Favored 'General case' 0 C--O 1.242 0.688 0 CA-C-O 121.765 0.793 . . . . 0.0 110.706 -176.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.934 0 CA-C-O 116.184 -2.453 . . . . 0.0 109.881 168.618 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.472 0.629 0 CA-C-O 118.6 -0.714 . . . . 0.0 112.55 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -172.83 -171.56 37.7 Favored Glycine 0 C--N 1.337 0.603 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 176.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -78.43 72.67 4.97 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.816 0.846 . . . . 0.0 108.752 170.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -133.05 -168.3 11.91 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 125.667 1.604 . . . . 0.0 110.465 -179.016 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -124.24 84.73 2.31 Favored 'General case' 0 CA--C 1.528 0.135 0 CA-C-O 122.252 1.025 . . . . 0.0 108.594 179.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.43 144.29 35.5 Favored Pre-proline 0 C--O 1.24 0.577 0 C-N-CA 127.32 2.248 . . . . 0.0 109.863 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -65.59 -47.42 4.11 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 122.262 1.975 . . . . 0.0 111.881 -177.704 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -146.58 145.94 25.15 Favored Pre-proline 0 C--O 1.234 0.281 0 N-CA-C 106.745 -1.576 . . . . 0.0 106.745 170.31 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -73.96 -34.6 5.01 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.15 1.9 . . . . 0.0 111.348 175.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -76.29 -7.75 55.6 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.994 1.317 . . . . 0.0 113.062 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.664 HD21 ' HB2' ' A' ' 15' ' ' ALA . 5.1 tt -60.05 107.73 0.67 Allowed 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.236 1.015 . . . . 0.0 108.742 170.411 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 33.3 mm -83.9 100.2 7.13 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 172.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 64.5 m95 -56.14 155.31 12.82 Favored Pre-proline 0 CA--C 1.544 0.72 0 O-C-N 121.486 -0.759 . . . . 0.0 111.696 178.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -67.79 169.34 53.82 Favored 'Cis proline' 0 N--CA 1.459 -0.544 0 C-N-CA 125.425 -0.656 . . . . 0.0 113.468 -4.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.664 ' HB2' HD21 ' A' ' 11' ' ' LEU . . . -135.64 170.24 16.28 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.515 0.726 . . . . 0.0 111.059 176.293 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 mt -136.96 106.9 6.27 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 126.951 2.1 . . . . 0.0 106.203 178.618 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.3 tp -70.26 146.87 50.34 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 105.597 -2.001 . . . . 0.0 105.597 161.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.27 88.48 2.02 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 173.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -61.41 158.11 15.38 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 123.1 1.428 . . . . 0.0 112.417 -158.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.27 134.93 40.98 Favored 'General case' 0 N--CA 1.431 -1.416 0 N-CA-C 105.598 -2.001 . . . . 0.0 105.598 178.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 88.69 -54.79 4.11 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 125.162 1.363 . . . . 0.0 111.137 -175.046 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -80.09 -13.65 59.12 Favored 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 115.327 1.603 . . . . 0.0 115.327 -159.521 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.507 ' HB3' ' HB1' ' A' ' 84' ' ' ALA . 6.5 m-80 64.47 -20.18 0.07 Allowed 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 121.664 2.029 . . . . 0.0 114.298 175.33 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -73.48 154.81 39.76 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 127.665 2.386 . . . . 0.0 109.525 178.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.9 mt -104.17 155.23 18.89 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 125.262 1.425 . . . . 0.0 109.147 -178.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -124.5 86.36 55.31 Favored Pre-proline 0 CA--C 1.538 0.506 0 C-N-CA 124.997 1.319 . . . . 0.0 108.975 177.014 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -68.68 114.82 3.65 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 124.509 3.473 . . . . 0.0 111.512 -177.667 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.8 mt -116.62 104.9 11.85 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 124.997 1.319 . . . . 0.0 108.447 -173.143 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -58.57 -44.7 89.85 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.22 0.533 . . . . 0.0 111.737 -177.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.3 p -151.44 174.47 13.33 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 124.878 1.271 . . . . 0.0 108.937 -162.301 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -69.38 -27.76 65.6 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 119.921 -0.712 . . . . 0.0 111.604 174.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -56.55 -32.8 65.49 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.298 0.954 . . . . 0.0 110.131 169.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -68.27 -42.98 78.79 Favored 'General case' 0 C--O 1.223 -0.302 0 O-C-N 120.988 -1.07 . . . . 0.0 110.05 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 31.3 t-105 -59.53 -32.19 70.08 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.514 -0.741 . . . . 0.0 112.02 174.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -65.12 -56.44 12.94 Favored 'General case' 0 CA--C 1.52 -0.178 0 O-C-N 121.067 -1.021 . . . . 0.0 109.057 175.202 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 87.3 mtm180 -57.14 -43.1 82.11 Favored 'General case' 0 C--O 1.221 -0.414 0 C-N-CA 124.073 0.949 . . . . 0.0 110.259 -179.415 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -50.26 -49.92 51.75 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 124.995 1.318 . . . . 0.0 112.38 174.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 8.9 t -74.27 -27.23 60.64 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 118.882 0.765 . . . . 0.0 111.527 -178.341 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.11 -41.72 70.22 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 118.686 0.676 . . . . 0.0 111.634 174.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -124.18 1.45 8.51 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -154.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 43.9 t -133.95 -72.08 0.5 Allowed 'General case' 0 C--O 1.234 0.26 0 C-N-CA 124.184 0.994 . . . . 0.0 108.756 174.428 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.7 ptmt 44.2 45.11 6.91 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 125.898 1.679 . . . . 0.0 113.254 177.096 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -68.76 66.26 0.13 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.669 1.988 . . . . 0.0 109.468 169.5 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.3 mp 49.61 -176.58 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 127.016 2.127 . . . . 0.0 112.977 -176.404 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 67.5 mt -143.03 127.08 17.39 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 106.375 -1.713 . . . . 0.0 106.375 161.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 -109.52 149.11 30.1 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 172.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.417 ' HA ' ' HB3' ' A' ' 61' ' ' LEU . 24.2 m-85 -70.16 70.62 0.39 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 126.674 1.99 . . . . 0.0 110.016 -178.181 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 160.76 2.97 0.06 OUTLIER Glycine 0 N--CA 1.439 -1.108 0 C-N-CA 123.553 0.597 . . . . 0.0 112.003 -172.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -65.35 -10.2 31.07 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 -172.412 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.7 ttmt 60.05 140.75 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 129.228 3.011 . . . . 0.0 111.997 174.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 5.7 mt -130.73 154.77 47.61 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 106.538 -1.653 . . . . 0.0 106.538 167.318 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 53.2 t -136.79 122.33 27.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 102.687 -3.079 . . . . 0.0 102.687 173.201 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -82.03 -165.54 1.02 Allowed 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 127.965 2.506 . . . . 0.0 112.486 167.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 83.6 p -73.06 -29.86 63.28 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 120.254 1.388 . . . . 0.0 114.043 176.18 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -83.18 1.47 40.44 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 126.224 1.81 . . . . 0.0 111.259 -168.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 65.46 22.7 11.89 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.615 1.966 . . . . 0.0 111.364 -173.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -66.76 112.49 4.26 Favored 'General case' 0 C--O 1.232 0.152 0 O-C-N 120.381 -1.449 . . . . 0.0 109.934 161.213 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 11.4 m -69.35 158.28 35.38 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 119.956 -0.698 . . . . 0.0 109.36 161.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -141.75 166.1 25.65 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 125.518 1.527 . . . . 0.0 109.445 172.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 34.1 t -144.46 134.44 19.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 C-N-CA 127.141 2.176 . . . . 0.0 107.209 177.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.417 ' HB3' ' HA ' ' A' ' 47' ' ' TYR . 0.2 OUTLIER -78.79 135.6 37.13 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 106.605 -1.628 . . . . 0.0 106.605 167.056 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -120.02 170.61 9.12 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 119.751 1.159 . . . . 0.0 111.92 174.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -54.91 -17.29 3.48 Favored 'General case' 0 N--CA 1.468 0.467 0 O-C-N 121.034 -1.041 . . . . 0.0 112.865 175.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -72.51 -5.29 35.94 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.551 1.14 . . . . 0.0 113.592 173.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 68.89 6.78 5.79 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 126.683 1.993 . . . . 0.0 112.574 -176.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -95.12 162.47 13.7 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 119.396 0.998 . . . . 0.0 111.667 171.648 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 56.5 m95 -107.51 78.7 1.23 Allowed 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 124.979 1.312 . . . . 0.0 108.59 178.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 63.0 t-80 -60.7 144.09 89.92 Favored Pre-proline 0 CA--C 1.545 0.75 0 CA-C-O 119.136 -0.459 . . . . 0.0 110.187 -171.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.82 113.23 3.48 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 124.103 3.202 . . . . 0.0 111.097 173.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -94.13 40.43 1.08 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.857 1.663 . . . . 0.0 111.24 -179.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.91 165.25 0.13 Allowed Pre-proline 0 CA--C 1.543 0.677 0 C-N-CA 127.856 2.462 . . . . 0.0 113.485 175.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -68.16 171.21 12.99 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.726 2.284 . . . . 0.0 112.025 167.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.0 tp -146.95 146.15 24.96 Favored Pre-proline 0 CA--C 1.534 0.335 0 C-N-CA 124.121 0.968 . . . . 0.0 111.41 -170.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -64.75 164.47 24.1 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 123.138 2.558 . . . . 0.0 113.384 171.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -61.17 -28.75 85.74 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 123.806 3.004 . . . . 0.0 112.809 174.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -82.51 -16.99 46.69 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 121.803 -0.561 . . . . 0.0 110.941 -179.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.93 -32.18 80.21 Favored Glycine 0 CA--C 1.534 1.263 0 N-CA-C 110.926 -0.87 . . . . 0.0 110.926 177.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 23.0 tp -58.71 -52.61 64.94 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.001 -1.293 . . . . 0.0 110.059 169.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -52.39 -27.33 15.3 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.885 0.874 . . . . 0.0 113.04 -174.128 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -72.07 -42.13 66.58 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.01 0.924 . . . . 0.0 112.171 178.242 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.5 mp -61.8 -44.83 96.08 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 123.909 0.884 . . . . 0.0 110.696 173.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 49.4 mm -55.83 -50.09 70.6 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 C-N-CA 123.713 0.805 . . . . 0.0 108.949 175.429 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.97 -46.19 10.96 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 125.475 1.51 . . . . 0.0 112.448 174.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.507 ' HB1' ' HB3' ' A' ' 23' ' ' ASN . . . -58.49 -51.4 70.02 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 123.457 0.473 . . . . 0.0 111.049 -177.156 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 26.5 t60 -61.24 -46.27 91.09 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.469 1.108 . . . . 0.0 110.508 177.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 73.1 m -60.97 -46.31 91.26 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 117.54 -1.219 . . . . 0.0 110.341 -178.001 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.84 -31.11 68.8 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 119.851 1.205 . . . . 0.0 112.22 -176.35 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 15.3 t -73.25 -5.88 42.32 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 117.727 -1.13 . . . . 0.0 111.878 176.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 90.0 mt -123.51 -62.33 1.32 Allowed 'General case' 0 C--N 1.342 0.267 0 CA-C-N 120.039 1.29 . . . . 0.0 110.405 -176.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 153.61 7.22 0.09 OUTLIER Glycine 0 CA--C 1.537 1.439 0 C-N-CA 126.907 2.194 . . . . 0.0 113.224 176.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 15.5 m170 -74.47 151.16 39.61 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 118.645 1.222 . . . . 0.0 109.468 -160.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 2.7 p -143.19 26.24 1.67 Allowed 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -161.355 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 1.7 p 57.43 -174.76 0.07 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 127.251 2.22 . . . . 0.0 109.356 -167.245 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 3.1 t -157.21 -47.49 0.07 Allowed 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 175.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.4 p -135.12 161.96 33.85 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 119.547 1.067 . . . . 0.0 109.776 173.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 57.28 -167.92 0.12 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.285 1.034 . . . . 0.0 111.631 173.232 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 33.6 ttp -80.02 62.07 4.1 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.498 1.119 . . . . 0.0 109.305 177.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 3.5 m80 61.69 -71.88 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.518 1.527 . . . . 0.0 110.006 -161.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.491 HD13 ' HB2' ' A' ' 105' ' ' ALA . 81.4 mt -137.28 158.76 43.71 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 125.895 1.678 . . . . 0.0 110.277 -160.815 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -120.22 -20.97 7.14 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 124.062 0.945 . . . . 0.0 110.744 -163.036 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 17.2 m -160.1 173.92 15.08 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 127.177 2.191 . . . . 0.0 108.2 170.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 41.0 t -61.11 -40.58 86.23 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.307 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 168.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 4.1 ttm -60.79 -41.67 96.04 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 118.513 0.597 . . . . 0.0 110.794 -178.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -58.22 -35.03 71.07 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-O 119.187 -0.435 . . . . 0.0 110.869 174.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.491 ' HB2' HD13 ' A' ' 99' ' ' LEU . . . -65.18 -39.97 93.61 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 118.721 0.691 . . . . 0.0 111.545 179.332 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.7 mm -59.92 -51.62 70.74 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 177.193 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -62.89 -49.26 75.52 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.366 1.066 . . . . 0.0 109.795 -176.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -55.26 -52.57 62.97 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 126.621 1.968 . . . . 0.0 111.784 179.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 41.2 mt -62.22 -37.78 86.66 Favored 'General case' 0 CA--C 1.523 -0.088 0 CA-C-N 117.679 0.218 . . . . 0.0 110.8 -172.284 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -78.38 -26.36 46.53 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 122.569 0.348 . . . . 0.0 111.38 177.026 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -74.64 -25.83 59.47 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 118.628 -0.701 . . . . 0.0 112.413 174.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 13.1 mt -66.34 -48.48 70.1 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 118.931 0.787 . . . . 0.0 110.304 177.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -66.71 143.44 56.96 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 122.49 0.316 . . . . 0.0 110.169 -178.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.71 0 N-CA-C 106.777 -2.529 . . . . 0.0 106.777 -173.548 . . . . . . . . 0 0 . 1 stop_ save_